methyl 2-[(3-cyanophenyl)methyl]-3-methyl-4-pyridin-3-yl-butanoate

Systemtic Name: methyl 2-[(3-cyanophenyl)methyl]-3-methyl-4-pyridin-3-yl-butanoate Openeye Name: methyl 2-[(3-cyanophenyl)methyl]-3-methyl-4-(3-pyridyl)butanoate CAS Name: 2-[(3-cyanophenyl)methyl]-3-methyl-4-(3-pyridinyl)butanoic acid methyl ester IUPAC Name: methyl 2-[(3-cyanophenyl)methyl]-3-methyl-4-pyridin-3-ylbutanoate Traditional Name: 2-(3-cyanobenzyl)-3-methyl-4-(3-pyridyl)butyric acid methyl ester Formula: C19H20N2O2 MolecularWeight: 308.3743

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CC=C1)C(CC2=CC=CC(=C2)C#N)C(=O)OC

Isomeric SMILES

CC(CC1=CN=CC=C1)C(CC2=CC=CC(=C2)C#N)C(=O)OC

InChI

InChI=1S/C19H20N2O2/c1-14(9-17-7-4-8-21-13-17)18(19(22)23-2)11-15-5-3-6-16(10-15)12-20/h3-8,10,13-14,18H,9,11H2,1-2H3