1-[[(4-nitrophenyl)-(4-nitrophenyl)sulfonyl-carbamoyl]-(4-nitrophenyl)sulfonyl-amino]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[[(4-nitrophenyl)-(4-nitrophenyl)sulfonyl-carbamoyl]-(4-nitrophenyl)sulfonyl-amino]cyclopentane-1-carboxylic acid Openeye Name: 1-[[(4-nitrophenyl)-(4-nitrophenyl)sulfonyl-carbamoyl]-(4-nitrophenyl)sulfonyl-amino]cyclopentanecarboxylic acid CAS Name: 1-[[(4-nitro-N-(4-nitrophenyl)sulfonylanilino)-oxomethyl]-(4-nitrophenyl)sulfonylamino]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[[(4-nitrophenyl)-(4-nitrophenyl)sulfonylcarbamoyl]-(4-nitrophenyl)sulfonylamino]cyclopentane-1-carboxylic acid Traditional Name: 1-[[(4-nitrophenyl)-nosyl-carbamoyl]-nosyl-amino]cyclopentanecarboxylic acid Formula: C25H21N5O13S2 MolecularWeight: 663.58994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)O)N(C(=O)N(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)(C(=O)O)N(C(=O)N(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21N5O13S2/c31-23(32)25(15-1-2-16-25)27(45(42,43)22-13-9-20(10-14-22)30(38)39)24(33)26(17-3-5-18(6-4-17)28(34)35)44(40,41)21-11-7-19(8-12-21)29(36)37/h3-14H,1-2,15-16H2,(H,31,32)