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

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-butylquinoline-4-carboxylate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 2-butylquinoline-4-carboxylate CAS Name: 2-butyl-4-quinolinecarboxylic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 2-butylquinoline-4-carboxylate Traditional Name: 2-butylcinchoninic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C23H23NO4/c1-3-4-9-17-14-20(19-11-5-6-12-21(19)24-17)23(26)28-15-22(25)16-8-7-10-18(13-16)27-2/h5-8,10-14H,3-4,9,15H2,1-2H3