methyl 1-(1-thiophen-2-ylsulfonylpiperidin-3-yl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylate

Systemtic Name: methyl 1-(1-thiophen-2-ylsulfonylpiperidin-3-yl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylate Openeye Name: methyl 1-[1-(2-thienylsulfonyl)piperidine-3-carbonyl]-3,4-dihydro-2H-quinoline-5-carboxylate CAS Name: 1-[oxo-(1-thiophen-2-ylsulfonyl-3-piperidinyl)methyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester IUPAC Name: methyl 1-(1-thiophen-2-ylsulfonylpiperidine-3-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylate Traditional Name: 1-[1-(2-thienylsulfonyl)nipecotoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCCN(C2=CC=C1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC(=O)C1=C2CCCN(C2=CC=C1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N2O5S2/c1-28-21(25)17-7-2-9-18-16(17)8-4-12-23(18)20(24)15-6-3-11-22(14-15)30(26,27)19-10-5-13-29-19/h2,5,7,9-10,13,15H,3-4,6,8,11-12,14H2,1H3