(E)-3-(3-methoxyphenyl)prop-2-enamide; 4-methylbenzenesulfonic acid

Systemtic Name: (E)-3-(3-methoxyphenyl)prop-2-enamide; 4-methylbenzenesulfonic acid Openeye Name: (E)-3-(3-methoxyphenyl)prop-2-enamide; 4-methylbenzenesulfonic acid CAS Name: (E)-3-(3-methoxyphenyl)-2-propenamide; 4-methylbenzenesulfonic acid IUPAC Name: (E)-3-(3-methoxyphenyl)prop-2-enamide; 4-methylbenzenesulfonic acid Traditional Name: (E)-3-(3-methoxyphenyl)acrylamide; tosylic acid Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.COC1=CC=CC(=C1)C=CC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.COC1=CC=CC(=C1)/C=C/C(=O)N

InChI

InChI=1S/C10H11NO2.C7H8O3S/c1-13-9-4-2-3-8(7-9)5-6-10(11)12;1-6-2-4-7(5-3-6)11(8,9)10/h2-7H,1H3,(H2,11,12);2-5H,1H3,(H,8,9,10)/b6-5+;