methyl 7-[2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]propanoylamino]-6-oxidanylidene-7H-benzo[d][1]benzazepine-5-carboxylate

Systemtic Name: methyl 7-[2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]propanoylamino]-6-oxidanylidene-7H-benzo[d][1]benzazepine-5-carboxylate Openeye Name: methyl 7-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]-6-oxo-7H-benzo[d][1]benzazepine-5-carboxylate CAS Name: 7-[[2-[[2-(3,5-difluorophenyl)-1-oxoethyl]amino]-1-oxopropyl]amino]-6-oxo-7H-benzo[d][1]benzazepine-5-carboxylic acid methyl ester IUPAC Name: methyl 7-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]-6-oxo-7H-benzo[d][1]benzazepine-5-carboxylate Traditional Name: 7-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]-6-keto-7H-benzo[d][1]benzazepine-5-carboxylic acid methyl ester Formula: C27H23F2N3O5 MolecularWeight: 507.485426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C(=O)OC)NC(=O)CC4=CC(=CC(=C4)F)F

Isomeric SMILES

CC(C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C(=O)OC)NC(=O)CC4=CC(=CC(=C4)F)F

InChI

InChI=1S/C27H23F2N3O5/c1-15(30-23(33)13-16-11-17(28)14-18(29)12-16)25(34)31-24-21-9-4-3-7-19(21)20-8-5-6-10-22(20)32(26(24)35)27(36)37-2/h3-12,14-15,24H,13H2,1-2H3,(H,30,33)(H,31,34)