(Z)-7-[4-[methyl(phenylsulfonyl)amino]phenyl]-7-pyridin-3-yl-hept-6-enoic acid

Systemtic Name: (Z)-7-[4-[methyl(phenylsulfonyl)amino]phenyl]-7-pyridin-3-yl-hept-6-enoic acid Openeye Name: (Z)-7-[4-[benzenesulfonyl(methyl)amino]phenyl]-7-(3-pyridyl)hept-6-enoic acid CAS Name: (Z)-7-[4-[benzenesulfonyl(methyl)amino]phenyl]-7-(3-pyridinyl)-6-heptenoic acid IUPAC Name: (Z)-7-[4-[benzenesulfonyl(methyl)amino]phenyl]-7-pyridin-3-ylhept-6-enoic acid Traditional Name: (Z)-7-[4-[besyl(methyl)amino]phenyl]-7-(3-pyridyl)hept-6-enoic acid Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=CCCCCC(=O)O)C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=C(C=C1)/C(=C/CCCCC(=O)O)/C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26N2O4S/c1-27(32(30,31)23-10-4-2-5-11-23)22-16-14-20(15-17-22)24(21-9-8-18-26-19-21)12-6-3-7-13-25(28)29/h2,4-5,8-12,14-19H,3,6-7,13H2,1H3,(H,28,29)/b24-12-