ethyl 2-butyl-4-[[4-(2-cyanophenyl)phenyl]-methyl-amino]pyridine-3-carboxylate

Systemtic Name: ethyl 2-butyl-4-[[4-(2-cyanophenyl)phenyl]-methyl-amino]pyridine-3-carboxylate Openeye Name: ethyl 2-butyl-4-[4-(2-cyanophenyl)-N-methyl-anilino]pyridine-3-carboxylate CAS Name: 2-butyl-4-[4-(2-cyanophenyl)-N-methylanilino]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-4-[4-(2-cyanophenyl)-N-methylanilino]pyridine-3-carboxylate Traditional Name: 2-butyl-4-[4-(2-cyanophenyl)-N-methyl-anilino]nicotinic acid ethyl ester Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=CC(=C1C(=O)OCC)N(C)C2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CCCCC1=NC=CC(=C1C(=O)OCC)N(C)C2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C26H27N3O2/c1-4-6-11-23-25(26(30)31-5-2)24(16-17-28-23)29(3)21-14-12-19(13-15-21)22-10-8-7-9-20(22)18-27/h7-10,12-17H,4-6,11H2,1-3H3