basic_info |
|
| Product_Name: | 1H-INDOLE-4-ACETONITRILE, 5-NITRO-1-(PHENYLMETHYL)- |
| CAS: | 120627-50-1 |
| EnglishSynonyms: | 1H-INDOLE-4-ACETONITRILE, 5-NITRO-1-(PHENYLMETHYL)- |
| pro_mdlNumber: | MFCD02090406 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | c1ccc(cc1)Cn2ccc3c2ccc(c3CC#N)[N+](=O)[O-] |
| InChi: | InChI=1S/C17H13N3O2/c18-10-8-14-15-9-11-19(12-13-4-2-1-3-5-13)16(15)6-7-17(14)20(21)22/h1-7,9,11H,8,12H2 |
| InChiKey: | InChIKey=NXNXQRLLOROGPU-UHFFFAOYSA-N |
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