[2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethyl] 3-methoxynaphthalene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethyl] 3-methoxynaphthalene-2-carboxylate Openeye Name: [2-(2-benzylsulfanylethylamino)-2-oxo-ethyl] 3-methoxynaphthalene-2-carboxylate CAS Name: 3-methoxy-2-naphthalenecarboxylic acid [2-oxo-2-[2-(phenylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-(2-benzylsulfanylethylamino)-2-oxoethyl] 3-methoxynaphthalene-2-carboxylate Traditional Name: 3-methoxynaphthalene-2-carboxylic acid [2-[2-(benzylthio)ethylamino]-2-keto-ethyl] ester Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)OCC(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)OCC(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C23H23NO4S/c1-27-21-14-19-10-6-5-9-18(19)13-20(21)23(26)28-15-22(25)24-11-12-29-16-17-7-3-2-4-8-17/h2-10,13-14H,11-12,15-16H2,1H3,(H,24,25)