(E)-2-cyclopentyl-2-[[(E)-2-(3-nitrophenyl)ethenyl]sulfonylamino]hept-5-enoic acid

Systemtic Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-nitrophenyl)ethenyl]sulfonylamino]hept-5-enoic acid Openeye Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-nitrophenyl)vinyl]sulfonylamino]hept-5-enoic acid CAS Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-nitrophenyl)ethenyl]sulfonylamino]-5-heptenoic acid IUPAC Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-nitrophenyl)ethenyl]sulfonylamino]hept-5-enoic acid Traditional Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-nitrophenyl)vinyl]sulfonylamino]hept-5-enoic acid Formula: C20H26N2O6S MolecularWeight: 422.49524

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC(C1CCCC1)(C(=O)O)NS(=O)(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C/C=C/CCC(C1CCCC1)(C(=O)O)NS(=O)(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H26N2O6S/c1-2-3-6-13-20(19(23)24,17-9-4-5-10-17)21-29(27,28)14-12-16-8-7-11-18(15-16)22(25)26/h2-3,7-8,11-12,14-15,17,21H,4-6,9-10,13H2,1H3,(H,23,24)/b3-2+,14-12+