tert-butyl 2-[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbonylbenzoate

Systemtic Name: tert-butyl 2-[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbonylbenzoate Openeye Name: tert-butyl 2-[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbonyl]benzoate CAS Name: 2-[[4-[1-[(4-methoxyphenyl)methyl]-2-imidazolyl]-1-piperidinyl]-oxomethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbonyl]benzoate Traditional Name: 2-[4-(1-p-anisylimidazol-2-yl)piperidine-1-carbonyl]benzoic acid tert-butyl ester Formula: C28H33N3O4 MolecularWeight: 475.57932

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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=C(C=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C28H33N3O4/c1-28(2,3)35-27(33)24-8-6-5-7-23(24)26(32)30-16-13-21(14-17-30)25-29-15-18-31(25)19-20-9-11-22(34-4)12-10-20/h5-12,15,18,21H,13-14,16-17,19H2,1-4H3