(E)-4-(3-[(SEC-BUTYLAMINO)CARBONYL]ANILINO)-4-OXO-2-BUTENOIC ACID

pro_cas
940498-87-3
pro_cdbregno
CCD00744502
pro_formula
C15 H18 N2 O4
pro_molWeight
290.317

basic_info

Product_Name: (E)-4-(3-[(SEC-BUTYLAMINO)CARBONYL]ANILINO)-4-OXO-2-BUTENOIC ACID
CAS: 940498-87-3
EnglishSynonyms: (2E)-3-((3-[(BUTAN-2-YL)CARBAMOYL]PHENYL)CARBAMOYL)PROP-2-ENOIC ACID ; (2E)-3-((3-[(SEC-BUTYL)CARBAMOYL]PHENYL)CARBAMOYL)PROP-2-ENOIC ACID ; 4-((3-[(SEC-BUTYLAMINO)CARBONYL]PHENYL)AMINO)-4-OXO-2-BUTENOIC ACID ; 2-BUTENOIC ACID, 4-[[3-[[(1-METHYLPROPYL)AMINO]CARBONYL]PHENYL]AMINO]-4-OXO- ; (E)-4-(3-[(SEC-BUTYLAMINO)CARBONYL]ANILINO)-4-OXO-2-BUTENOIC ACID
pro_mdlNumber: MFCD09439099
pro_acceptors: 6
pro_donors: 3
pro_smile: CCC(C)NC(=O)c1cccc(c1)NC(=O)/C=C/C(=O)O
InChi: InChI=1S/C15H18N2O4/c1-3-10(2)16-15(21)11-5-4-6-12(9-11)17-13(18)7-8-14(19)20/h4-10H,3H2,1-2H3,(H,16,21)(H,17,18)(H,19,20)/b8-7+
InChiKey: InChIKey=NRFLSOCEGGWWGU-BQYQJAHWSA-N

property

Comments: WARNINGS: IRRITANT

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