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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=CC(=O)N2CCCC3=C(C=CC=C32)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1/C=C/C(=O)N2CCCC3=C(C=CC=C32)C(=O)O

InChI

InChI=1S/C21H21NO4/c1-2-26-19-11-4-3-7-15(19)12-13-20(23)22-14-6-9-16-17(21(24)25)8-5-10-18(16)22/h3-5,7-8,10-13H,2,6,9,14H2,1H3,(H,24,25)/b13-12+