[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-propylquinoline-4-carboxylate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-propylquinoline-4-carboxylate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 2-propylquinoline-4-carboxylate CAS Name: 2-propyl-4-quinolinecarboxylic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 2-propylquinoline-4-carboxylate Traditional Name: 2-propylcinchoninic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H21NO4/c1-3-7-16-13-19(18-10-4-5-11-20(18)23-16)22(25)27-14-21(24)15-8-6-9-17(12-15)26-2/h4-6,8-13H,3,7,14H2,1-2H3