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

Systemtic Name: methyl (E)-6-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-6-pyridin-3-yl-hex-5-enoate Openeye Name: methyl (E)-6-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-6-(3-pyridyl)hex-5-enoate CAS Name: (E)-6-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-6-(3-pyridinyl)-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-6-pyridin-3-ylhex-5-enoate Traditional Name: (E)-6-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-6-(3-pyridyl)hex-5-enoic acid methyl ester Formula: C26H27ClN2O4S MolecularWeight: 499.02158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27ClN2O4S/c1-33-26(30)7-3-2-6-25(22-5-4-17-28-19-22)21-10-8-20(9-11-21)16-18-29-34(31,32)24-14-12-23(27)13-15-24/h4-6,8-15,17,19,29H,2-3,7,16,18H2,1H3/b25-6+