tert-butyl 2-[4-[[(4Z)-2-butyl-5-oxidanylidene-4-(phenylmethylidene)imidazol-1-yl]methyl]phenyl]benzoate

Systemtic Name: tert-butyl 2-[4-[[(4Z)-2-butyl-5-oxidanylidene-4-(phenylmethylidene)imidazol-1-yl]methyl]phenyl]benzoate Openeye Name: tert-butyl 2-[4-[[(4Z)-4-benzylidene-2-butyl-5-oxo-imidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[(4Z)-2-butyl-5-oxo-4-(phenylmethylene)-1-imidazolyl]methyl]phenyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[[(4Z)-4-benzylidene-2-butyl-5-oxoimidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[(4Z)-4-benzal-2-butyl-5-keto-2-imidazolin-1-yl]methyl]phenyl]benzoic acid tert-butyl ester Formula: C32H34N2O3 MolecularWeight: 494.62396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CC2=CC=CC=C2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=N/C(=C\C2=CC=CC=C2)/C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC(C)(C)C

InChI

InChI=1S/C32H34N2O3/c1-5-6-16-29-33-28(21-23-12-8-7-9-13-23)30(35)34(29)22-24-17-19-25(20-18-24)26-14-10-11-15-27(26)31(36)37-32(2,3)4/h7-15,17-21H,5-6,16,22H2,1-4H3/b28-21-