[4-[(4-methoxyphenyl)sulfonyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butyl]amino]-3,3-dimethyl-butyl] (4-nitrophenyl) carbonate

Systemtic Name: [4-[(4-methoxyphenyl)sulfonyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butyl]amino]-3,3-dimethyl-butyl] (4-nitrophenyl) carbonate Openeye Name: [4-[[3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]-(4-methoxyphenyl)sulfonyl-amino]-3,3-dimethyl-butyl] (4-nitrophenyl) carbonate CAS Name: carbonic acid [4-[[2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-phenylbutyl]-(4-methoxyphenyl)sulfonylamino]-3,3-dimethylbutyl] (4-nitrophenyl) ester IUPAC Name: [4-[[2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylbutyl]-(4-methoxyphenyl)sulfonylamino]-3,3-dimethylbutyl] (4-nitrophenyl) carbonate Traditional Name: carbonic acid [4-[[3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]-(4-methoxyphenyl)sulfonyl-amino]-3,3-dimethyl-butyl] (4-nitrophenyl) ester Formula: C35H45N3O11S MolecularWeight: 715.8103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(CC(C)(C)CCOC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)OC)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(CC(C)(C)CCOC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)OC)O

InChI

InChI=1S/C35H45N3O11S/c1-34(2,3)49-32(40)36-30(22-25-10-8-7-9-11-25)31(39)23-37(50(44,45)29-18-16-27(46-6)17-19-29)24-35(4,5)20-21-47-33(41)48-28-14-12-26(13-15-28)38(42)43/h7-19,30-31,39H,20-24H2,1-6H3,(H,36,40)