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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)NCC1=C(C=C(C=C1)C(=O)N2CCCCC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)CC(=O)NCC1=C(C=C(C=C1)C(=O)N2CCCCC3=CC=CC=C32)C

InChI

InChI=1S/C24H28N2O4/c1-3-30-23(28)15-22(27)25-16-20-12-11-19(14-17(20)2)24(29)26-13-7-6-9-18-8-4-5-10-21(18)26/h4-5,8,10-12,14H,3,6-7,9,13,15-16H2,1-2H3,(H,25,27)