tert-butyl 2-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbonylbenzoate

Systemtic Name: tert-butyl 2-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbonylbenzoate Openeye Name: tert-butyl 2-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbonyl]benzoate CAS Name: 2-[[4-[1-[(3,5-dimethoxyphenyl)methyl]-2-imidazolyl]-1-piperidinyl]-oxomethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbonyl]benzoate Traditional Name: 2-[4-[1-(3,5-dimethoxybenzyl)imidazol-2-yl]piperidine-1-carbonyl]benzoic acid tert-butyl ester Formula: C29H35N3O5 MolecularWeight: 505.6053

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=CC=C1C(=O)N2CCC(CC2)C3=NC=CN3CC4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=CC=C1C(=O)N2CCC(CC2)C3=NC=CN3CC4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C29H35N3O5/c1-29(2,3)37-28(34)25-9-7-6-8-24(25)27(33)31-13-10-21(11-14-31)26-30-12-15-32(26)19-20-16-22(35-4)18-23(17-20)36-5/h6-9,12,15-18,21H,10-11,13-14,19H2,1-5H3