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2-nitro-N-[3-[3-[(2-nitrophenyl)sulfonylamino]propyl-(phenylmethyl)amino]propyl]benzenesulfonamide
2-nitro-N-[3-[3-[(2-nitrophenyl)sulfonylamino]propyl-(phenylmethyl)amino]propyl]benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C(C=C1)CN(CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])CCCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]
Isomeric SMILES
C1=CC=C(C=C1)CN(CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])CCCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]
InChI
InChI=1S/C25H29N5O8S2/c31-29(32)22-12-4-6-14-24(22)39(35,36)26-16-8-18-28(20-21-10-2-1-3-11-21)19-9-17-27-40(37,38)25-15-7-5-13-23(25)30(33)34/h1-7,10-15,26-27H,8-9,16-20H2
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