tert-butyl 3-[bis[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]propanoate

Systemtic Name: tert-butyl 3-[bis[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]propanoate Openeye Name: tert-butyl 3-[bis[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]propanoate CAS Name: 3-[bis[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[bis[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]propanoate Traditional Name: 3-[bis[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]propionic acid tert-butyl ester Formula: C25H35N5O10S2 MolecularWeight: 629.7029

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCN(CCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CCN(CCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C25H35N5O10S2/c1-25(2,3)40-24(31)14-19-28(17-8-15-26-41(36,37)22-12-6-4-10-20(22)29(32)33)18-9-16-27-42(38,39)23-13-7-5-11-21(23)30(34)35/h4-7,10-13,26-27H,8-9,14-19H2,1-3H3