[2-oxidanylidene-2-(propan-2-ylamino)ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C17H18ClNO3S MolecularWeight: 351.84772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC(=O)CSC1=CC=CC2=C1C(=CC=C2)Cl

Isomeric SMILES

CC(C)NC(=O)COC(=O)CSC1=CC=CC2=C1C(=CC=C2)Cl

InChI

InChI=1S/C17H18ClNO3S/c1-11(2)19-15(20)9-22-16(21)10-23-14-8-4-6-12-5-3-7-13(18)17(12)14/h3-8,11H,9-10H2,1-2H3,(H,19,20)