(E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methyl-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methylphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methylphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methyl-phenyl]acrylic acid Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)N2CCCC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C(=O)O)S(=O)(=O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C19H19NO4S/c1-14-8-9-15(10-11-19(21)22)13-18(14)25(23,24)20-12-4-6-16-5-2-3-7-17(16)20/h2-3,5,7-11,13H,4,6,12H2,1H3,(H,21,22)/b11-10+