2-[(3S)-5-acetyloxy-3-azanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[(3S)-5-acetyloxy-3-azanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[(3S)-5-acetoxy-3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[(3S)-5-acetyloxy-3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[(3S)-5-acetyloxy-3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[(3S)-5-acetoxy-3-amino-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(C(=O)N(C2=CC=CC=C12)CC(=O)O)N

Isomeric SMILES

CC(=O)OC1C[C@@H](C(=O)N(C2=CC=CC=C12)CC(=O)O)N

InChI

InChI=1S/C14H16N2O5/c1-8(17)21-12-6-10(15)14(20)16(7-13(18)19)11-5-3-2-4-9(11)12/h2-5,10,12H,6-7,15H2,1H3,(H,18,19)/t10-,12?/m0/s1