tert-butyl 3-[2-[2-oxidanylidene-1-[4-(6-phenylhexanoyl)piperazin-1-yl]carbonyl-4-phenylmethoxycarbonyl-azetidin-3-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-[2-oxidanylidene-1-[4-(6-phenylhexanoyl)piperazin-1-yl]carbonyl-4-phenylmethoxycarbonyl-azetidin-3-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-[2-benzyloxycarbonyl-4-oxo-1-[4-(6-phenylhexanoyl)piperazine-1-carbonyl]azetidin-3-yl]ethyl]piperidine-1-carboxylate CAS Name: 3-[2-[2-oxo-1-[oxo-[4-(1-oxo-6-phenylhexyl)-1-piperazinyl]methyl]-4-phenylmethoxycarbonyl-3-azetidinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[2-oxo-1-[4-(6-phenylhexanoyl)piperazine-1-carbonyl]-4-phenylmethoxycarbonylazetidin-3-yl]ethyl]piperidine-1-carboxylate Traditional Name: 3-[2-[2-carbobenzoxy-4-keto-1-[4-(6-phenylhexanoyl)piperazine-1-carbonyl]azetidin-3-yl]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C40H54N4O7 MolecularWeight: 702.87936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CCC2C(N(C2=O)C(=O)N3CCN(CC3)C(=O)CCCCCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CCC2C(N(C2=O)C(=O)N3CCN(CC3)C(=O)CCCCCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C40H54N4O7/c1-40(2,3)51-39(49)43-23-13-19-31(28-43)21-22-33-35(37(47)50-29-32-17-10-5-11-18-32)44(36(33)46)38(48)42-26-24-41(25-27-42)34(45)20-12-6-9-16-30-14-7-4-8-15-30/h4-5,7-8,10-11,14-15,17-18,31,33,35H,6,9,12-13,16,19-29H2,1-3H3