phenethyl 4-[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-2-oxidanylidene-4-phenylmethoxycarbonyl-azetidin-1-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: phenethyl 4-[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-2-oxidanylidene-4-phenylmethoxycarbonyl-azetidin-1-yl]carbonylpiperazine-1-carboxylate Openeye Name: phenethyl 4-[2-benzyloxycarbonyl-3-[3-[bis(benzyloxycarbonylamino)methyleneamino]propyl]-4-oxo-azetidine-1-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-2-oxo-4-phenylmethoxycarbonyl-1-azetidinyl]-oxomethyl]-1-piperazinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 4-[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-2-oxo-4-phenylmethoxycarbonylazetidine-1-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-[3-[bis(benzyloxycarbonylamino)methyleneamino]propyl]-2-carbobenzoxy-4-keto-azetidine-1-carbonyl]piperazine-1-carboxylic acid phenethyl ester Formula: C45H48N6O10 MolecularWeight: 832.89682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)N2C(C(C2=O)CCCN=C(NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5)C(=O)OCCC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C(=O)N2C(C(C2=O)CCCN=C(NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5)C(=O)OCCC6=CC=CC=C6

InChI

InChI=1S/C45H48N6O10/c52-39-37(22-13-24-46-41(47-42(54)60-31-35-18-9-3-10-19-35)48-43(55)61-32-36-20-11-4-12-21-36)38(40(53)59-30-34-16-7-2-8-17-34)51(39)44(56)49-25-27-50(28-26-49)45(57)58-29-23-33-14-5-1-6-15-33/h1-12,14-21,37-38H,13,22-32H2,(H2,46,47,48,54,55)