methyl 1-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 6-keto-1-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]nicotinic acid methyl ester Formula: C23H23N3O6S MolecularWeight: 469.51022

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H23N3O6S/c1-32-23(29)19-7-9-21(27)25(15-19)16-22(28)24-10-12-26(13-11-24)33(30,31)20-8-6-17-4-2-3-5-18(17)14-20/h2-9,14-15H,10-13,16H2,1H3