5-methyl-2-oxidanyl-3-[(E)-3-[3-[(E)-2-quinolin-2-ylethenyl]phenyl]prop-2-enoyl]benzoic acid

Systemtic Name: 5-methyl-2-oxidanyl-3-[(E)-3-[3-[(E)-2-quinolin-2-ylethenyl]phenyl]prop-2-enoyl]benzoic acid Openeye Name: 2-hydroxy-5-methyl-3-[(E)-3-[3-[(E)-2-(2-quinolyl)vinyl]phenyl]prop-2-enoyl]benzoic acid CAS Name: 2-hydroxy-5-methyl-3-[(E)-1-oxo-3-[3-[(E)-2-(2-quinolinyl)ethenyl]phenyl]prop-2-enyl]benzoic acid IUPAC Name: 2-hydroxy-5-methyl-3-[(E)-3-[3-[(E)-2-quinolin-2-ylethenyl]phenyl]prop-2-enoyl]benzoic acid Traditional Name: 2-hydroxy-5-methyl-3-[(E)-3-[3-[(E)-2-(2-quinolyl)vinyl]phenyl]acryloyl]benzoic acid Formula: C28H21NO4 MolecularWeight: 435.47064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)C=CC2=CC=CC(=C2)C=CC3=NC4=CC=CC=C4C=C3)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)/C=C/C2=CC=CC(=C2)/C=C/C3=NC4=CC=CC=C4C=C3)O)C(=O)O

InChI

InChI=1S/C28H21NO4/c1-18-15-23(27(31)24(16-18)28(32)33)26(30)14-10-20-6-4-5-19(17-20)9-12-22-13-11-21-7-2-3-8-25(21)29-22/h2-17,31H,1H3,(H,32,33)/b12-9+,14-10+