[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-naphthalen-2-ylsulfonylpropanoate

Systemtic Name: [2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-naphthalen-2-ylsulfonylpropanoate Openeye Name: [2-(4-methoxyanilino)-2-oxo-ethyl] 3-(2-naphthylsulfonyl)propanoate CAS Name: 3-(2-naphthalenylsulfonyl)propanoic acid [2-(4-methoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyanilino)-2-oxoethyl] 3-naphthalen-2-ylsulfonylpropanoate Traditional Name: 3-(2-naphthylsulfonyl)propionic acid [2-keto-2-(p-anisidino)ethyl] ester Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)COC(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)COC(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H21NO6S/c1-28-19-9-7-18(8-10-19)23-21(24)15-29-22(25)12-13-30(26,27)20-11-6-16-4-2-3-5-17(16)14-20/h2-11,14H,12-13,15H2,1H3,(H,23,24)