4,4-bis(2-methylphenyl)butyl 1-[4,4-bis(2-methylphenyl)butyl]-4-phenyl-4H-pyridine-3-carboxylate

Systemtic Name: 4,4-bis(2-methylphenyl)butyl 1-[4,4-bis(2-methylphenyl)butyl]-4-phenyl-4H-pyridine-3-carboxylate Openeye Name: 4,4-bis(o-tolyl)butyl 1-[4,4-bis(o-tolyl)butyl]-4-phenyl-4H-pyridine-3-carboxylate CAS Name: 1-[4,4-bis(2-methylphenyl)butyl]-4-phenyl-4H-pyridine-3-carboxylic acid 4,4-bis(2-methylphenyl)butyl ester IUPAC Name: 4,4-bis(2-methylphenyl)butyl 1-[4,4-bis(2-methylphenyl)butyl]-4-phenyl-4H-pyridine-3-carboxylate Traditional Name: 1-[4,4-bis(o-tolyl)butyl]-4-phenyl-4H-pyridine-3-carboxylic acid 4,4-bis(o-tolyl)butyl ester Formula: C48H51NO2 MolecularWeight: 673.92404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCCN2C=CC(C(=C2)C(=O)OCCCC(C3=CC=CC=C3C)C4=CC=CC=C4C)C5=CC=CC=C5)C6=CC=CC=C6C

Isomeric SMILES

CC1=CC=CC=C1C(CCCN2C=CC(C(=C2)C(=O)OCCCC(C3=CC=CC=C3C)C4=CC=CC=C4C)C5=CC=CC=C5)C6=CC=CC=C6C

InChI

InChI=1S/C48H51NO2/c1-35-18-8-12-24-40(35)45(41-25-13-9-19-36(41)2)28-16-31-49-32-30-44(39-22-6-5-7-23-39)47(34-49)48(50)51-33-17-29-46(42-26-14-10-20-37(42)3)43-27-15-11-21-38(43)4/h5-15,18-27,30,32,34,44-46H,16-17,28-29,31,33H2,1-4H3