quinolin-8-ylmethyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: quinolin-8-ylmethyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: 8-quinolylmethyl 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid 8-quinolylmethyl ester Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C21H19NO3/c1-15-7-9-16(10-8-15)19(23)11-12-20(24)25-14-18-5-2-4-17-6-3-13-22-21(17)18/h2-10,13H,11-12,14H2,1H3