1-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[(E)-3-(2-methoxy-5-methylphenyl)-1-oxoprop-2-enyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[(E)-3-(2-methoxy-5-methylphenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[(E)-3-(2-methoxy-5-methyl-phenyl)acryloyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO4/c1-14-8-10-19(26-2)15(13-14)9-11-20(23)22-12-4-6-16-17(21(24)25)5-3-7-18(16)22/h3,5,7-11,13H,4,6,12H2,1-2H3,(H,24,25)/b11-9+