[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-pent-2-enoate

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-pent-2-enoate Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl] (E)-pent-2-enoate CAS Name: (E)-2-pentenoic acid [2-(4-bromo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl] (E)-pent-2-enoate Traditional Name: (E)-pent-2-enoic acid [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C14H16BrNO3 MolecularWeight: 326.18574

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(=O)OCC(=O)NC1=C(C=C(C=C1)Br)C

Isomeric SMILES

CC/C=C/C(=O)OCC(=O)NC1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C14H16BrNO3/c1-3-4-5-14(18)19-9-13(17)16-12-7-6-11(15)8-10(12)2/h4-8H,3,9H2,1-2H3,(H,16,17)/b5-4+