(6-azanyl-2-naphthalen-1-yl-5-oxidanylidene-1,4-thiazepan-4-yl) ethanoate

Systemtic Name: (6-azanyl-2-naphthalen-1-yl-5-oxidanylidene-1,4-thiazepan-4-yl) ethanoate Openeye Name: [6-amino-2-(1-naphthyl)-5-oxo-1,4-thiazepan-4-yl] acetate CAS Name: acetic acid [6-amino-2-(1-naphthalenyl)-5-oxo-1,4-thiazepan-4-yl] ester IUPAC Name: (6-amino-2-naphthalen-1-yl-5-oxo-1,4-thiazepan-4-yl) acetate Traditional Name: acetic acid [6-amino-5-keto-2-(1-naphthyl)-1,4-thiazepan-4-yl] ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1CC(SCC(C1=O)N)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(=O)ON1CC(SCC(C1=O)N)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C17H18N2O3S/c1-11(20)22-19-9-16(23-10-15(18)17(19)21)14-8-4-6-12-5-2-3-7-13(12)14/h2-8,15-16H,9-10,18H2,1H3