tert-butyl N-[(4-nitrophenyl)methyl-(4-oxidanyl-6-phenyl-hexanoyl)amino]carbamate

Systemtic Name: tert-butyl N-[(4-nitrophenyl)methyl-(4-oxidanyl-6-phenyl-hexanoyl)amino]carbamate Openeye Name: tert-butyl N-[(4-hydroxy-6-phenyl-hexanoyl)-[(4-nitrophenyl)methyl]amino]carbamate CAS Name: N-[(4-hydroxy-1-oxo-6-phenylhexyl)-[(4-nitrophenyl)methyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4-hydroxy-6-phenylhexanoyl)-[(4-nitrophenyl)methyl]amino]carbamate Traditional Name: N-[(4-hydroxy-6-phenyl-hexanoyl)-(4-nitrobenzyl)amino]carbamic acid tert-butyl ester Formula: C24H31N3O6 MolecularWeight: 457.51944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)CCC(CCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)NN(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)CCC(CCC2=CC=CC=C2)O

InChI

InChI=1S/C24H31N3O6/c1-24(2,3)33-23(30)25-26(17-19-9-12-20(13-10-19)27(31)32)22(29)16-15-21(28)14-11-18-7-5-4-6-8-18/h4-10,12-13,21,28H,11,14-17H2,1-3H3,(H,25,30)