methyl (E)-5-[(3-bromophenyl)methylamino]pent-2-enoate

Systemtic Name: methyl (E)-5-[(3-bromophenyl)methylamino]pent-2-enoate Openeye Name: methyl (E)-5-[(3-bromophenyl)methylamino]pent-2-enoate CAS Name: (E)-5-[(3-bromophenyl)methylamino]-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-5-[(3-bromophenyl)methylamino]pent-2-enoate Traditional Name: (E)-5-[(3-bromobenzyl)amino]pent-2-enoic acid methyl ester Formula: C13H16BrNO2 MolecularWeight: 298.17564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CCCNCC1=CC(=CC=C1)Br

Isomeric SMILES

COC(=O)/C=C/CCNCC1=CC(=CC=C1)Br

InChI

InChI=1S/C13H16BrNO2/c1-17-13(16)7-2-3-8-15-10-11-5-4-6-12(14)9-11/h2,4-7,9,15H,3,8,10H2,1H3/b7-2+