ethyl 3-[(4-methylphenyl)sulfonylamino]-2-(4-methylpyridin-1-ium-1-yl)prop-2-enoate

Systemtic Name: ethyl 3-[(4-methylphenyl)sulfonylamino]-2-(4-methylpyridin-1-ium-1-yl)prop-2-enoate Openeye Name: ethyl 2-(4-methylpyridin-1-ium-1-yl)-3-(p-tolylsulfonylamino)prop-2-enoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]-2-(4-methyl-1-pyridin-1-iumyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl 3-[(4-methylphenyl)sulfonylamino]-2-(4-methylpyridin-1-ium-1-yl)prop-2-enoate Traditional Name: 2-(4-methylpyridin-1-ium-1-yl)-3-(tosylamino)acrylic acid ethyl ester Formula: C18H21N2O4S+ MolecularWeight: 361.43534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNS(=O)(=O)C1=CC=C(C=C1)C)[N+]2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C(=CNS(=O)(=O)C1=CC=C(C=C1)C)[N+]2=CC=C(C=C2)C

InChI

InChI=1S/C18H20N2O4S/c1-4-24-18(21)17(20-11-9-15(3)10-12-20)13-19-25(22,23)16-7-5-14(2)6-8-16/h5-13H,4H2,1-3H3/p+1