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

Systemtic Name: 5-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)phenyl]methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylamino]-5-oxo-pentanoic acid CAS Name: 5-[[2-methyl-4-[oxo(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methyl]phenyl]methylamino]-5-oxopentanoic acid IUPAC Name: 5-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methylamino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzyl]amino]valeric acid Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O4/c1-17-15-19(12-13-20(17)16-25-22(27)10-6-11-23(28)29)24(30)26-14-5-4-8-18-7-2-3-9-21(18)26/h2-3,7,9,12-13,15H,4-6,8,10-11,14,16H2,1H3,(H,25,27)(H,28,29)