tert-butyl N-[4-[[2,2-dimethyl-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-(3-nitrophenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[[2,2-dimethyl-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-(3-nitrophenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-3-[[2,2-dimethyl-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-(3-nitrophenyl)sulfonyl-amino]-2-hydroxy-propyl]carbamate CAS Name: N-[4-[[2,2-dimethyl-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-(3-nitrophenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[2,2-dimethyl-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-(3-nitrophenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-3-[[2,2-dimethyl-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-(3-nitrophenyl)sulfonyl-amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C31H45N3O9S MolecularWeight: 635.7687

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CCC(C)(C)CN(CC(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1(OCCO1)CCC(C)(C)CN(CC(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C31H45N3O9S/c1-29(2,3)43-28(36)32-26(19-23-11-8-7-9-12-23)27(35)21-33(22-30(4,5)15-16-31(6)41-17-18-42-31)44(39,40)25-14-10-13-24(20-25)34(37)38/h7-14,20,26-27,35H,15-19,21-22H2,1-6H3,(H,32,36)