[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl 6-butyl-4-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl 6-butyl-4-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [4-(2-tert-butoxycarbonylphenyl)phenyl]methyl 6-butyl-4-oxo-1H-pyridine-3-carboxylate CAS Name: 6-butyl-4-oxo-1H-pyridine-3-carboxylic acid [4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]methyl ester IUPAC Name: [4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl 6-butyl-4-oxo-1H-pyridine-3-carboxylate Traditional Name: 6-butyl-4-keto-1H-pyridine-3-carboxylic acid [4-(2-tert-butoxycarbonylphenyl)benzyl] ester Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)C(=CN1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC(=O)C(=CN1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C

InChI

InChI=1S/C28H31NO5/c1-5-6-9-21-16-25(30)24(17-29-21)26(31)33-18-19-12-14-20(15-13-19)22-10-7-8-11-23(22)27(32)34-28(2,3)4/h7-8,10-17H,5-6,9,18H2,1-4H3,(H,29,30)