2-[[4-oxidanyl-3-(phenylmethoxycarbonylamino)butyl]amino]-3-[1-(triphenylmethyl)imidazol-4-yl]propanoate

Systemtic Name: 2-[[4-oxidanyl-3-(phenylmethoxycarbonylamino)butyl]amino]-3-[1-(triphenylmethyl)imidazol-4-yl]propanoate Openeye Name: 2-[[3-(benzyloxycarbonylamino)-4-hydroxy-butyl]amino]-3-(1-tritylimidazol-4-yl)propanoate CAS Name: 2-[[4-hydroxy-3-(phenylmethoxycarbonylamino)butyl]amino]-3-[1-(triphenylmethyl)-4-imidazolyl]propanoate IUPAC Name: 2-[[4-hydroxy-3-(phenylmethoxycarbonylamino)butyl]amino]-3-(1-tritylimidazol-4-yl)propanoate Traditional Name: 2-[[3-(benzyloxycarbonylamino)-4-hydroxy-butyl]amino]-3-(1-tritylimidazol-4-yl)propionate Formula: C37H37N4O5- MolecularWeight: 617.71348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCNC(CC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)[O-])CO

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCNC(CC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)[O-])CO

InChI

InChI=1S/C37H38N4O5/c42-25-32(40-36(45)46-26-28-13-5-1-6-14-28)21-22-38-34(35(43)44)23-33-24-41(27-39-33)37(29-15-7-2-8-16-29,30-17-9-3-10-18-30)31-19-11-4-12-20-31/h1-20,24,27,32,34,38,42H,21-23,25-26H2,(H,40,45)(H,43,44)/p-1