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

Systemtic Name: 1-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[(E)-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[(E)-3-(3-methoxyphenyl)acryloyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C20H19NO4 MolecularWeight: 337.36916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)N2CCCC3=C(C=CC=C32)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)N2CCCC3=C(C=CC=C32)C(=O)O

InChI

InChI=1S/C20H19NO4/c1-25-15-6-2-5-14(13-15)10-11-19(22)21-12-4-8-16-17(20(23)24)7-3-9-18(16)21/h2-3,5-7,9-11,13H,4,8,12H2,1H3,(H,23,24)/b11-10+