methyl 6-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonylpyridine-2-carboxylate

Systemtic Name: methyl 6-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonylpyridine-2-carboxylate Openeye Name: methyl 6-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)pyridine-2-carboxylate CAS Name: 6-[[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazine-1-carbonyl]pyridine-2-carboxylate Traditional Name: 6-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)picolinic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC(=O)C1=CC=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H23N3O5S/c1-29-21(26)19-7-3-6-18(22-19)20(25)23-10-12-24(13-11-23)30(27,28)17-9-8-15-4-2-5-16(15)14-17/h3,6-9,14H,2,4-5,10-13H2,1H3