ethyl 4-[[3-(4-methylpiperidin-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfonylamino]benzoate

Systemtic Name: ethyl 4-[[3-(4-methylpiperidin-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfonylamino]benzoate Openeye Name: ethyl 4-[[3-(4-methyl-1-piperidyl)-1,4-dioxo-2-naphthyl]sulfonylamino]benzoate CAS Name: 4-[[3-(4-methyl-1-piperidinyl)-1,4-dioxo-2-naphthalenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-methylpiperidin-1-yl)-1,4-dioxonaphthalen-2-yl]sulfonylamino]benzoate Traditional Name: 4-[[1,4-diketo-3-(4-methylpiperidino)-2-naphthyl]sulfonylamino]benzoic acid ethyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCC(CC4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCC(CC4)C

InChI

InChI=1S/C25H26N2O6S/c1-3-33-25(30)17-8-10-18(11-9-17)26-34(31,32)24-21(27-14-12-16(2)13-15-27)22(28)19-6-4-5-7-20(19)23(24)29/h4-11,16,26H,3,12-15H2,1-2H3