methyl 2-[3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]-3-[1-(triphenylmethyl)imidazol-4-yl]propanoate

Systemtic Name: methyl 2-[3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]-3-[1-(triphenylmethyl)imidazol-4-yl]propanoate Openeye Name: methyl 2-[3-(benzyloxycarbonylamino)pyrrolidin-1-yl]-3-(1-tritylimidazol-4-yl)propanoate CAS Name: 2-[3-(phenylmethoxycarbonylamino)-1-pyrrolidinyl]-3-[1-(triphenylmethyl)-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]-3-(1-tritylimidazol-4-yl)propanoate Traditional Name: 2-[3-(benzyloxycarbonylamino)pyrrolidino]-3-(1-tritylimidazol-4-yl)propionic acid methyl ester Formula: C38H38N4O4 MolecularWeight: 614.73272

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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)N5CCC(C5)NC(=O)OCC6=CC=CC=C6

Isomeric SMILES

COC(=O)C(CC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N5CCC(C5)NC(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C38H38N4O4/c1-45-36(43)35(41-23-22-33(25-41)40-37(44)46-27-29-14-6-2-7-15-29)24-34-26-42(28-39-34)38(30-16-8-3-9-17-30,31-18-10-4-11-19-31)32-20-12-5-13-21-32/h2-21,26,28,33,35H,22-25,27H2,1H3,(H,40,44)