1-[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[3-(3,5-dimethylpiperidino)sulfonylbenzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C24H28N2O5S MolecularWeight: 456.55452

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCC4=C(C=CC=C43)C(=O)O)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCC4=C(C=CC=C43)C(=O)O)C

InChI

InChI=1S/C24H28N2O5S/c1-16-12-17(2)15-25(14-16)32(30,31)19-7-3-6-18(13-19)23(27)26-11-5-9-20-21(24(28)29)8-4-10-22(20)26/h3-4,6-8,10,13,16-17H,5,9,11-12,14-15H2,1-2H3,(H,28,29)