N-[4-[[(5E)-5-(cyanomethylidene)-3,4-dihydro-2H-1-benzazepin-1-yl]carbonyl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[[(5E)-5-(cyanomethylidene)-3,4-dihydro-2H-1-benzazepin-1-yl]carbonyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[(5E)-5-(cyanomethylene)-3,4-dihydro-2H-1-benzazepine-1-carbonyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[(5E)-5-(cyanomethylidene)-3,4-dihydro-2H-1-benzazepin-1-yl]-oxomethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[(5E)-5-(cyanomethylidene)-3,4-dihydro-2H-1-benzazepine-1-carbonyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[(5E)-5-(cyanomethylene)-3,4-dihydro-2H-1-benzazepine-1-carbonyl]phenyl]-2-methyl-benzamide Formula: C27H23N3O2 MolecularWeight: 421.49042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCCC(=CC#N)C4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCC/C(=C\C#N)/C4=CC=CC=C43

InChI

InChI=1S/C27H23N3O2/c1-19-7-2-3-9-23(19)26(31)29-22-14-12-21(13-15-22)27(32)30-18-6-8-20(16-17-28)24-10-4-5-11-25(24)30/h2-5,7,9-16H,6,8,18H2,1H3,(H,29,31)/b20-16+