(2S)-2-azanyl-N-(6-oxidanylidene-7H-benzo[d][1]benzazepin-5-yl)propanamide hydrochloride

Systemtic Name: (2S)-2-azanyl-N-(6-oxidanylidene-7H-benzo[d][1]benzazepin-5-yl)propanamide hydrochloride Openeye Name: (2S)-2-amino-N-(6-oxo-7H-benzo[d][1]benzazepin-5-yl)propanamide hydrochloride CAS Name: (2S)-2-amino-N-(6-oxo-7H-benzo[d][1]benzazepin-5-yl)propanamide hydrochloride IUPAC Name: (2S)-2-amino-N-(6-oxo-7H-benzo[d][1]benzazepin-5-yl)propanamide hydrochloride Traditional Name: (2S)-2-amino-N-(6-keto-7H-benzo[d][1]benzazepin-5-yl)propionamide hydrochloride Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN1C(=O)CC2=CC=CC=C2C3=CC=CC=C31)N.Cl

Isomeric SMILES

C[C@@H](C(=O)NN1C(=O)CC2=CC=CC=C2C3=CC=CC=C31)N.Cl

InChI

InChI=1S/C17H17N3O2.ClH/c1-11(18)17(22)19-20-15-9-5-4-8-14(15)13-7-3-2-6-12(13)10-16(20)21;/h2-9,11H,10,18H2,1H3,(H,19,22);1H/t11-;/m0./s1