ethyl 5-[(E)-pent-1-enyl]-4-(4-phenylphenyl)-2,6-di(propan-2-yl)pyridine-3-carboxylate

Systemtic Name: ethyl 5-[(E)-pent-1-enyl]-4-(4-phenylphenyl)-2,6-di(propan-2-yl)pyridine-3-carboxylate Openeye Name: ethyl 2,6-diisopropyl-5-[(E)-pent-1-enyl]-4-(4-phenylphenyl)pyridine-3-carboxylate CAS Name: 5-[(E)-pent-1-enyl]-4-(4-phenylphenyl)-2,6-di(propan-2-yl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-pent-1-enyl]-4-(4-phenylphenyl)-2,6-di(propan-2-yl)pyridine-3-carboxylate Traditional Name: 2,6-diisopropyl-5-[(E)-pent-1-enyl]-4-(4-phenylphenyl)nicotinic acid ethyl ester Formula: C31H37NO2 MolecularWeight: 455.63098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1=C(C(=C(N=C1C(C)C)C(C)C)C(=O)OCC)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCC/C=C/C1=C(C(=C(N=C1C(C)C)C(C)C)C(=O)OCC)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C31H37NO2/c1-7-9-11-16-26-27(25-19-17-24(18-20-25)23-14-12-10-13-15-23)28(31(33)34-8-2)30(22(5)6)32-29(26)21(3)4/h10-22H,7-9H2,1-6H3/b16-11+