methyl 2-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]ethanoate

Systemtic Name: methyl 2-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]ethanoate Openeye Name: methyl 2-[[(E)-3-(2-bromo-4-methyl-phenyl)prop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-3-(2-bromo-4-methylphenyl)-1-oxoprop-2-enyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(2-bromo-4-methylphenyl)prop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-3-(2-bromo-4-methyl-phenyl)acryloyl]amino]acetic acid methyl ester Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CC(=O)NCC(=O)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/C(=O)NCC(=O)OC)Br

InChI

InChI=1S/C13H14BrNO3/c1-9-3-4-10(11(14)7-9)5-6-12(16)15-8-13(17)18-2/h3-7H,8H2,1-2H3,(H,15,16)/b6-5+