tert-butyl 2-[4-[(2-methanoyl-5-methyl-2-propyl-1H-imidazol-3-yl)methyl]phenyl]benzoate

Systemtic Name: tert-butyl 2-[4-[(2-methanoyl-5-methyl-2-propyl-1H-imidazol-3-yl)methyl]phenyl]benzoate Openeye Name: tert-butyl 2-[4-[(2-formyl-5-methyl-2-propyl-1H-imidazol-3-yl)methyl]phenyl]benzoate CAS Name: 2-[4-[(2-formyl-5-methyl-2-propyl-1H-imidazol-3-yl)methyl]phenyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(2-formyl-5-methyl-2-propyl-1H-imidazol-3-yl)methyl]phenyl]benzoate Traditional Name: 2-[4-[(2-formyl-4-methyl-2-propyl-4-imidazolin-1-yl)methyl]phenyl]benzoic acid tert-butyl ester Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(NC(=CN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C)C=O

Isomeric SMILES

CCCC1(NC(=CN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C)C=O

InChI

InChI=1S/C26H32N2O3/c1-6-15-26(18-29)27-19(2)16-28(26)17-20-11-13-21(14-12-20)22-9-7-8-10-23(22)24(30)31-25(3,4)5/h7-14,16,18,27H,6,15,17H2,1-5H3