[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-(3-fluoro-4-methyl-anilino)-2-oxo-ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: 3-(1,3-benzodioxol-5-yl)-2-propenoic acid [2-(3-fluoro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoro-4-methylanilino)-2-oxoethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: 3-(1,3-benzodioxol-5-yl)acrylic acid [2-(3-fluoro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C19H16FNO5 MolecularWeight: 357.332443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C=CC2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C=CC2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C19H16FNO5/c1-12-2-5-14(9-15(12)20)21-18(22)10-24-19(23)7-4-13-3-6-16-17(8-13)26-11-25-16/h2-9H,10-11H2,1H3,(H,21,22)