tert-butyl (1S,2S)-2-[[[[(4-methylphenyl)sulfonylamino]-nitro-methylidene]amino]methyl]-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropane-1-carboxylate

Systemtic Name: tert-butyl (1S,2S)-2-[[[[(4-methylphenyl)sulfonylamino]-nitro-methylidene]amino]methyl]-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropane-1-carboxylate Openeye Name: tert-butyl (1S,2S)-1-(tert-butoxycarbonylamino)-2-[[[nitro-(p-tolylsulfonylamino)methylene]amino]methyl]cyclopropanecarboxylate CAS Name: (1S,2S)-2-[[[[(4-methylphenyl)sulfonylamino]-nitromethylidene]amino]methyl]-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclopropanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,2S)-2-[[[[(4-methylphenyl)sulfonylamino]-nitromethylidene]amino]methyl]-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropane-1-carboxylate Traditional Name: (1S,2S)-1-(tert-butoxycarbonylamino)-2-[[[nitro-(tosylamino)methylene]amino]methyl]cyclopropanecarboxylic acid tert-butyl ester Formula: C22H32N4O8S MolecularWeight: 512.57648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCC2CC2(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NC[C@@H]2C[C@]2(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H32N4O8S/c1-14-8-10-16(11-9-14)35(31,32)25-18(26(29)30)23-13-15-12-22(15,17(27)33-20(2,3)4)24-19(28)34-21(5,6)7/h8-11,15H,12-13H2,1-7H3,(H,23,25)(H,24,28)/t15-,22-/m0/s1