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

Systemtic Name: tert-butyl 4-[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-4-oxidanylidene-azetidin-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[3-[bis(benzyloxycarbonylamino)methyleneamino]propyl]-4-oxo-azetidine-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-4-oxo-2-azetidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[3-[bis(phenylmethoxycarbonylamino)methylideneamino]propyl]-4-oxoazetidine-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-[3-[bis(benzyloxycarbonylamino)methyleneamino]propyl]-4-keto-azetidine-2-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C33H42N6O8 MolecularWeight: 650.72198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2C(C(=O)N2)CCCN=C(NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2C(C(=O)N2)CCCN=C(NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H42N6O8/c1-33(2,3)47-32(44)39-19-17-38(18-20-39)28(41)26-25(27(40)35-26)15-10-16-34-29(36-30(42)45-21-23-11-6-4-7-12-23)37-31(43)46-22-24-13-8-5-9-14-24/h4-9,11-14,25-26H,10,15-22H2,1-3H3,(H,35,40)(H2,34,36,37,42,43)