(2S)-2-[(4S)-4-acetamido-3-oxidanylidene-4,5-dihydro-1H-2-benzazepin-2-yl]-N-methyl-propanamide

Systemtic Name: (2S)-2-[(4S)-4-acetamido-3-oxidanylidene-4,5-dihydro-1H-2-benzazepin-2-yl]-N-methyl-propanamide Openeye Name: (2S)-2-[(4S)-4-acetamido-3-oxo-4,5-dihydro-1H-2-benzazepin-2-yl]-N-methyl-propanamide CAS Name: (2S)-2-[(4S)-4-acetamido-3-oxo-4,5-dihydro-1H-2-benzazepin-2-yl]-N-methylpropanamide IUPAC Name: (2S)-2-[(4S)-4-acetamido-3-oxo-4,5-dihydro-1H-2-benzazepin-2-yl]-N-methylpropanamide Traditional Name: (2S)-2-[(4S)-4-acetamido-3-keto-4,5-dihydro-1H-2-benzazepin-2-yl]-N-methyl-propionamide Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)N1CC2=CC=CC=C2CC(C1=O)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)NC)N1CC2=CC=CC=C2C[C@@H](C1=O)NC(=O)C

InChI

InChI=1S/C16H21N3O3/c1-10(15(21)17-3)19-9-13-7-5-4-6-12(13)8-14(16(19)22)18-11(2)20/h4-7,10,14H,8-9H2,1-3H3,(H,17,21)(H,18,20)/t10-,14-/m0/s1