4-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[2-methyl-4-[oxo(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methyl]phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzyl]amino]butyric acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCCCC3=CC=CC=C32)CNC(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCCCC3=CC=CC=C32)CNC(=O)CCC(=O)O

InChI

InChI=1S/C23H26N2O4/c1-16-14-18(9-10-19(16)15-24-21(26)11-12-22(27)28)23(29)25-13-5-4-7-17-6-2-3-8-20(17)25/h2-3,6,8-10,14H,4-5,7,11-13,15H2,1H3,(H,24,26)(H,27,28)