quinolin-8-yl 4-methyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: quinolin-8-yl 4-methyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: 8-quinolyl 4-methyl-3-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-methyl-3-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 4-methyl-3-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-methyl-3-(4-methylpiperidino)sulfonyl-benzoic acid 8-quinolyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C23H24N2O4S/c1-16-10-13-25(14-11-16)30(27,28)21-15-19(9-8-17(21)2)23(26)29-20-7-3-5-18-6-4-12-24-22(18)20/h3-9,12,15-16H,10-11,13-14H2,1-2H3