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

Systemtic Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-methylphenyl)ethenyl]sulfonylamino]hept-5-enoic acid Openeye Name: (E)-2-cyclopentyl-2-[[(E)-2-(m-tolyl)vinyl]sulfonylamino]hept-5-enoic acid CAS Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-methylphenyl)ethenyl]sulfonylamino]-5-heptenoic acid IUPAC Name: (E)-2-cyclopentyl-2-[[(E)-2-(3-methylphenyl)ethenyl]sulfonylamino]hept-5-enoic acid Traditional Name: (E)-2-cyclopentyl-2-[[(E)-2-(m-tolyl)vinyl]sulfonylamino]hept-5-enoic acid Formula: C21H29NO4S MolecularWeight: 391.52426

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC(C1CCCC1)(C(=O)O)NS(=O)(=O)C=CC2=CC(=CC=C2)C

Isomeric SMILES

C/C=C/CCC(C1CCCC1)(C(=O)O)NS(=O)(=O)/C=C/C2=CC(=CC=C2)C

InChI

InChI=1S/C21H29NO4S/c1-3-4-7-14-21(20(23)24,19-11-5-6-12-19)22-27(25,26)15-13-18-10-8-9-17(2)16-18/h3-4,8-10,13,15-16,19,22H,5-7,11-12,14H2,1-2H3,(H,23,24)/b4-3+,15-13+