4-BR-2-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE

CAS号
769153-36-8
CCD编号
CCD00487231
分子式
C27 H26 Br N3 O5
分子量
552.422

基本信息

产品名称: 4-BR-2-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
CAS: 769153-36-8
英文同义词: 4-BR-2-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
MDL号: MFCD05153435
氢键受体数量: 8
氢键供体数量: 2
Smile: CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2/C=N/NC(=O)C(=O)Nc3ccc(cc3)CC)Br
InChi: InChI=1S/C27H26BrN3O5/c1-3-15-35-23-12-7-19(8-13-23)27(34)36-24-14-9-21(28)16-20(24)17-29-31-26(33)25(32)30-22-10-5-18(4-2)6-11-22/h5-14,16-17H,3-4,15H2,1-2H3,(H,30,32)(H,31,33)/b29-17+
InChiKey: InChIKey=KMHZVEAWIOPEEN-STBIYBPSSA-N

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