methyl 3-methoxy-4-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-methoxy-4-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-methoxy-4-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethoxy]benzoate CAS Name: 3-methoxy-4-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethoxy]-3-methoxy-benzoic acid methyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26N2O7S/c1-32-23-16-20(25(29)33-2)8-10-22(23)34-17-24(28)26-11-13-27(14-12-26)35(30,31)21-9-7-18-5-3-4-6-19(18)15-21/h3-10,15-16H,11-14,17H2,1-2H3