1-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[1-[(E)-styryl]sulfonylpiperidine-4-carbonyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[oxo-[1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]methyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carbonyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[1-[(E)-styryl]sulfonylisonipecotoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2N(C1)C(=O)C3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2N(C1)C(=O)C3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H26N2O5S/c27-23(26-14-5-9-20-21(24(28)29)8-4-10-22(20)26)19-11-15-25(16-12-19)32(30,31)17-13-18-6-2-1-3-7-18/h1-4,6-8,10,13,17,19H,5,9,11-12,14-16H2,(H,28,29)/b17-13+