[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-prop-2-enoxyphenyl)prop-2-enoate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-prop-2-enoxyphenyl)prop-2-enoate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] (E)-3-(4-allyloxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-prop-2-enoxyphenyl)-2-propenoic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] (E)-3-(4-prop-2-enoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-allyloxyphenyl)acrylic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C=CC2=CC=C(C=C2)OCC=C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)/C=C/C2=CC=C(C=C2)OCC=C)Br

InChI

InChI=1S/C21H20BrNO4/c1-3-12-26-17-8-5-16(6-9-17)7-11-21(25)27-14-20(24)23-19-10-4-15(2)13-18(19)22/h3-11,13H,1,12,14H2,2H3,(H,23,24)/b11-7+