methyl 2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: methyl 2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate Openeye Name: methyl 2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate CAS Name: 2-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate Traditional Name: 2-(4-p-phenetylsulfonylpiperazino)nicotinic acid methyl ester Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC=N3)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC=N3)C(=O)OC

InChI

InChI=1S/C19H23N3O5S/c1-3-27-15-6-8-16(9-7-15)28(24,25)22-13-11-21(12-14-22)18-17(19(23)26-2)5-4-10-20-18/h4-10H,3,11-14H2,1-2H3