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

Systemtic Name: methyl (2S)-2-(2-phenylethanoylamino)-3-[1-(triphenylmethyl)imidazol-4-yl]propanoate Openeye Name: methyl (2S)-2-[(2-phenylacetyl)amino]-3-(1-tritylimidazol-4-yl)propanoate CAS Name: (2S)-2-[(1-oxo-2-phenylethyl)amino]-3-[1-(triphenylmethyl)-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-phenylacetyl)amino]-3-(1-tritylimidazol-4-yl)propanoate Traditional Name: (2S)-2-[(2-phenylacetyl)amino]-3-(1-tritylimidazol-4-yl)propionic acid methyl ester Formula: C34H31N3O3 MolecularWeight: 529.62824

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

COC(=O)[C@H](CC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C34H31N3O3/c1-40-33(39)31(36-32(38)22-26-14-6-2-7-15-26)23-30-24-37(25-35-30)34(27-16-8-3-9-17-27,28-18-10-4-11-19-28)29-20-12-5-13-21-29/h2-21,24-25,31H,22-23H2,1H3,(H,36,38)/t31-/m0/s1