(4-nitrophenyl)methyl N-[1-cyclohexyl-3-oxidanyl-5-oxidanylidene-5-(pyrrolidin-3-ylamino)pentan-2-yl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[1-cyclohexyl-3-oxidanyl-5-oxidanylidene-5-(pyrrolidin-3-ylamino)pentan-2-yl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[1-(cyclohexylmethyl)-2-hydroxy-4-oxo-4-(pyrrolidin-3-ylamino)butyl]carbamate CAS Name: N-[1-cyclohexyl-3-hydroxy-5-oxo-5-(3-pyrrolidinylamino)pentan-2-yl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[1-cyclohexyl-3-hydroxy-5-oxo-5-(pyrrolidin-3-ylamino)pentan-2-yl]carbamate Traditional Name: N-[1-(cyclohexylmethyl)-2-hydroxy-4-keto-4-(pyrrolidin-3-ylamino)butyl]carbamic acid (4-nitrobenzyl) ester Formula: C23H34N4O6 MolecularWeight: 462.53926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(CC(=O)NC2CCNC2)O)NC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)CC(C(CC(=O)NC2CCNC2)O)NC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H34N4O6/c28-21(13-22(29)25-18-10-11-24-14-18)20(12-16-4-2-1-3-5-16)26-23(30)33-15-17-6-8-19(9-7-17)27(31)32/h6-9,16,18,20-21,24,28H,1-5,10-15H2,(H,25,29)(H,26,30)