tert-butyl N-[4-(2-methylpropylamino)-4-(4-nitrophenyl)sulfonyl-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-(2-methylpropylamino)-4-(4-nitrophenyl)sulfonyl-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-hydroxy-3-(isobutylamino)-3-(4-nitrophenyl)sulfonyl-propyl]carbamate CAS Name: N-[3-hydroxy-4-(2-methylpropylamino)-4-(4-nitrophenyl)sulfonyl-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-hydroxy-4-(2-methylpropylamino)-4-(4-nitrophenyl)sulfonyl-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-hydroxy-3-(isobutylamino)-3-nosyl-propyl]carbamic acid tert-butyl ester Formula: C25H35N3O7S MolecularWeight: 521.6263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(C(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(C(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C25H35N3O7S/c1-17(2)16-26-23(36(33,34)20-13-11-19(12-14-20)28(31)32)22(29)21(15-18-9-7-6-8-10-18)27-24(30)35-25(3,4)5/h6-14,17,21-23,26,29H,15-16H2,1-5H3,(H,27,30)