2-(8-azanyl-2-methyl-3-oxidanylidene-4,5-dihydro-1H-2-benzazepin-4-yl)ethanoate

Systemtic Name: 2-(8-azanyl-2-methyl-3-oxidanylidene-4,5-dihydro-1H-2-benzazepin-4-yl)ethanoate Openeye Name: 2-(8-amino-2-methyl-3-oxo-4,5-dihydro-1H-2-benzazepin-4-yl)acetate CAS Name: 2-(8-amino-2-methyl-3-oxo-4,5-dihydro-1H-2-benzazepin-4-yl)acetate IUPAC Name: 2-(8-amino-2-methyl-3-oxo-4,5-dihydro-1H-2-benzazepin-4-yl)acetate Traditional Name: 2-(8-amino-3-keto-2-methyl-4,5-dihydro-1H-2-benzazepin-4-yl)acetate Formula: C13H15N2O3- MolecularWeight: 247.2698

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(CC(C1=O)CC(=O)[O-])C=CC(=C2)N

Isomeric SMILES

CN1CC2=C(CC(C1=O)CC(=O)[O-])C=CC(=C2)N

InChI

InChI=1S/C13H16N2O3/c1-15-7-10-5-11(14)3-2-8(10)4-9(13(15)18)6-12(16)17/h2-3,5,9H,4,6-7,14H2,1H3,(H,16,17)/p-1