methyl 2-(2-phenylethanoylamino)-2-(phenylmethyl)-3-[1-(triphenylmethyl)imidazol-4-yl]propanoate

Systemtic Name: methyl 2-(2-phenylethanoylamino)-2-(phenylmethyl)-3-[1-(triphenylmethyl)imidazol-4-yl]propanoate Openeye Name: methyl 2-benzyl-2-[(2-phenylacetyl)amino]-3-(1-tritylimidazol-4-yl)propanoate CAS Name: 2-[(1-oxo-2-phenylethyl)amino]-2-(phenylmethyl)-3-[1-(triphenylmethyl)-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 2-benzyl-2-[(2-phenylacetyl)amino]-3-(1-tritylimidazol-4-yl)propanoate Traditional Name: 2-benzyl-2-[(2-phenylacetyl)amino]-3-(1-tritylimidazol-4-yl)propionic acid methyl ester Formula: C41H37N3O3 MolecularWeight: 619.75078

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)(CC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)NC(=O)CC6=CC=CC=C6

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)(CC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)NC(=O)CC6=CC=CC=C6

InChI

InChI=1S/C41H37N3O3/c1-47-39(46)40(28-33-19-9-3-10-20-33,43-38(45)27-32-17-7-2-8-18-32)29-37-30-44(31-42-37)41(34-21-11-4-12-22-34,35-23-13-5-14-24-35)36-25-15-6-16-26-36/h2-26,30-31H,27-29H2,1H3,(H,43,45)