methyl 4-(3-cyanophenyl)-5-[di(propan-2-yl)amino]-5-oxidanylidene-3-pyridin-3-yl-pentanoate

Systemtic Name: methyl 4-(3-cyanophenyl)-5-[di(propan-2-yl)amino]-5-oxidanylidene-3-pyridin-3-yl-pentanoate Openeye Name: methyl 4-(3-cyanophenyl)-5-(diisopropylamino)-5-oxo-3-(3-pyridyl)pentanoate CAS Name: 4-(3-cyanophenyl)-5-[di(propan-2-yl)amino]-5-oxo-3-(3-pyridinyl)pentanoic acid methyl ester IUPAC Name: methyl 4-(3-cyanophenyl)-5-[di(propan-2-yl)amino]-5-oxo-3-pyridin-3-ylpentanoate Traditional Name: 4-(3-cyanophenyl)-5-(diisopropylamino)-5-keto-3-(3-pyridyl)valeric acid methyl ester Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O3/c1-16(2)27(17(3)4)24(29)23(19-9-6-8-18(12-19)14-25)21(13-22(28)30-5)20-10-7-11-26-15-20/h6-12,15-17,21,23H,13H2,1-5H3