tert-butyl N-[2-[(2-nitrophenyl)sulfonyl-[[6-[[(2-nitrophenyl)sulfonylamino]methyl]pyridin-2-yl]methyl]amino]ethyl]-N-(3-oxidanylpropyl)carbamate

Systemtic Name: tert-butyl N-[2-[(2-nitrophenyl)sulfonyl-[[6-[[(2-nitrophenyl)sulfonylamino]methyl]pyridin-2-yl]methyl]amino]ethyl]-N-(3-oxidanylpropyl)carbamate Openeye Name: tert-butyl N-(3-hydroxypropyl)-N-[2-[(2-nitrophenyl)sulfonyl-[[6-[[(2-nitrophenyl)sulfonylamino]methyl]-2-pyridyl]methyl]amino]ethyl]carbamate CAS Name: N-(3-hydroxypropyl)-N-[2-[(2-nitrophenyl)sulfonyl-[[6-[[(2-nitrophenyl)sulfonylamino]methyl]-2-pyridinyl]methyl]amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-hydroxypropyl)-N-[2-[(2-nitrophenyl)sulfonyl-[[6-[[(2-nitrophenyl)sulfonylamino]methyl]pyridin-2-yl]methyl]amino]ethyl]carbamate Traditional Name: N-(3-hydroxypropyl)-N-[2-[(2-nitrophenyl)sulfonyl-[[6-[[(2-nitrophenyl)sulfonylamino]methyl]-2-pyridyl]methyl]amino]ethyl]carbamic acid tert-butyl ester Formula: C29H36N6O11S2 MolecularWeight: 708.75974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCO)CCN(CC1=CC=CC(=N1)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCO)CCN(CC1=CC=CC(=N1)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C29H36N6O11S2/c1-29(2,3)46-28(37)32(16-9-19-36)17-18-33(48(44,45)27-15-7-5-13-25(27)35(40)41)21-23-11-8-10-22(31-23)20-30-47(42,43)26-14-6-4-12-24(26)34(38)39/h4-8,10-15,30,36H,9,16-21H2,1-3H3