[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-(4-bromanyl-8-chloranyl-naphthalen-1-yl)sulfanylethanoate

Systemtic Name: [2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-(4-bromanyl-8-chloranyl-naphthalen-1-yl)sulfanylethanoate Openeye Name: [2-(4-methyl-1-piperidyl)-2-oxo-ethyl] 2-[(4-bromo-8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(4-bromo-8-chloro-1-naphthalenyl)thio]acetic acid [2-(4-methyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2-(4-bromo-8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(4-bromo-8-chloro-1-naphthyl)thio]acetic acid [2-keto-2-(4-methylpiperidino)ethyl] ester Formula: C20H21BrClNO3S MolecularWeight: 470.80764

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)COC(=O)CSC2=C3C(=C(C=C2)Br)C=CC=C3Cl

Isomeric SMILES

CC1CCN(CC1)C(=O)COC(=O)CSC2=C3C(=C(C=C2)Br)C=CC=C3Cl

InChI

InChI=1S/C20H21BrClNO3S/c1-13-7-9-23(10-8-13)18(24)11-26-19(25)12-27-17-6-5-15(21)14-3-2-4-16(22)20(14)17/h2-6,13H,7-12H2,1H3