tert-butyl 4-[2-aminocarbonyl-3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-4-oxidanylidene-azetidin-1-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-aminocarbonyl-3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-4-oxidanylidene-azetidin-1-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[3-[bis(benzyloxycarbonylamino)methyleneamino]propyl]-2-carbamoyl-4-oxo-azetidine-1-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-2-carbamoyl-4-oxo-1-azetidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-2-carbamoyl-4-oxoazetidine-1-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-[3-[bis(benzyloxycarbonylamino)methyleneamino]propyl]-2-carbamoyl-4-keto-azetidine-1-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C34H43N7O9 MolecularWeight: 693.74672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)N2C(C(C2=O)CCCN=C(NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)N2C(C(C2=O)CCCN=C(NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C34H43N7O9/c1-34(2,3)50-33(47)40-19-17-39(18-20-40)32(46)41-26(27(35)42)25(28(41)43)15-10-16-36-29(37-30(44)48-21-23-11-6-4-7-12-23)38-31(45)49-22-24-13-8-5-9-14-24/h4-9,11-14,25-26H,10,15-22H2,1-3H3,(H2,35,42)(H2,36,37,38,44,45)