[3-(pyridin-4-ylmethoxy)phenyl] 4-(2-methylphenyl)-5-oxidanylidene-pentanoate

Systemtic Name: [3-(pyridin-4-ylmethoxy)phenyl] 4-(2-methylphenyl)-5-oxidanylidene-pentanoate Openeye Name: [3-(4-pyridylmethoxy)phenyl] 4-(o-tolyl)-5-oxo-pentanoate CAS Name: 4-(2-methylphenyl)-5-oxopentanoic acid [3-(pyridin-4-ylmethoxy)phenyl] ester IUPAC Name: [3-(pyridin-4-ylmethoxy)phenyl] 4-(2-methylphenyl)-5-oxopentanoate Traditional Name: 5-keto-4-(o-tolyl)valeric acid [3-(4-pyridylmethoxy)phenyl] ester Formula: C24H23NO4 MolecularWeight: 389.44372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)OC2=CC(=CC=C2)OCC3=CC=NC=C3)C=O

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)OC2=CC(=CC=C2)OCC3=CC=NC=C3)C=O

InChI

InChI=1S/C24H23NO4/c1-18-5-2-3-8-23(18)20(16-26)9-10-24(27)29-22-7-4-6-21(15-22)28-17-19-11-13-25-14-12-19/h2-8,11-16,20H,9-10,17H2,1H3