ethyl 4-[[1-(4-butylphenyl)piperidin-4-yl]amino]-2,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: ethyl 4-[[1-(4-butylphenyl)piperidin-4-yl]amino]-2,6-dimethyl-pyridine-3-carboxylate Openeye Name: ethyl 4-[[1-(4-butylphenyl)-4-piperidyl]amino]-2,6-dimethyl-pyridine-3-carboxylate CAS Name: 4-[[1-(4-butylphenyl)-4-piperidinyl]amino]-2,6-dimethyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-butylphenyl)piperidin-4-yl]amino]-2,6-dimethylpyridine-3-carboxylate Traditional Name: 4-[[1-(4-butylphenyl)-4-piperidyl]amino]-2,6-dimethyl-nicotinic acid ethyl ester Formula: C25H35N3O2 MolecularWeight: 409.5643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CCC(CC2)NC3=CC(=NC(=C3C(=O)OCC)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2CCC(CC2)NC3=CC(=NC(=C3C(=O)OCC)C)C

InChI

InChI=1S/C25H35N3O2/c1-5-7-8-20-9-11-22(12-10-20)28-15-13-21(14-16-28)27-23-17-18(3)26-19(4)24(23)25(29)30-6-2/h9-12,17,21H,5-8,13-16H2,1-4H3,(H,26,27)