2-[[2-oxidanylidene-1-(2-oxidanylidenepropyl)-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid

Systemtic Name: 2-[[2-oxidanylidene-1-(2-oxidanylidenepropyl)-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid Openeye Name: 2-[(1-acetonyl-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl)amino]-4-phenyl-butanoic acid CAS Name: 2-[[2-oxo-1-(2-oxopropyl)-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[[2-oxo-1-(2-oxopropyl)-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[(1-acetonyl-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl)amino]-4-phenyl-butyric acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C2=CC=CC=C2CCC(C1=O)NC(CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(=O)CN1C2=CC=CC=C2CCC(C1=O)NC(CCC3=CC=CC=C3)C(=O)O

InChI

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