methyl (E)-6-[4-[2-(phenylsulfonylamino)ethyl]phenyl]-6-pyridin-3-yl-hex-5-enoate

Systemtic Name: methyl (E)-6-[4-[2-(phenylsulfonylamino)ethyl]phenyl]-6-pyridin-3-yl-hex-5-enoate Openeye Name: methyl (E)-6-[4-[2-(benzenesulfonamido)ethyl]phenyl]-6-(3-pyridyl)hex-5-enoate CAS Name: (E)-6-[4-[2-(benzenesulfonamido)ethyl]phenyl]-6-(3-pyridinyl)-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-[4-[2-(benzenesulfonamido)ethyl]phenyl]-6-pyridin-3-ylhex-5-enoate Traditional Name: (E)-6-[4-[2-(benzenesulfonamido)ethyl]phenyl]-6-(3-pyridyl)hex-5-enoic acid methyl ester Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=C(C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

COC(=O)CCC/C=C(\C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=CC=C2)/C3=CN=CC=C3

InChI

InChI=1S/C26H28N2O4S/c1-32-26(29)12-6-5-11-25(23-8-7-18-27-20-23)22-15-13-21(14-16-22)17-19-28-33(30,31)24-9-3-2-4-10-24/h2-4,7-11,13-16,18,20,28H,5-6,12,17,19H2,1H3/b25-11+