ethyl (E)-3-[4-[2-[(4-bromophenyl)methyl-methyl-amino]ethanoylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[2-[(4-bromophenyl)methyl-methyl-amino]ethanoylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[[2-[(4-bromophenyl)methyl-methyl-amino]acetyl]amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[2-[(4-bromophenyl)methyl-methylamino]-1-oxoethyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[[2-[(4-bromophenyl)methyl-methylamino]acetyl]amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[[2-[(4-bromobenzyl)-methyl-amino]acetyl]amino]phenyl]acrylic acid ethyl ester Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)NC(=O)CN(C)CC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=C(C=C1)NC(=O)CN(C)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H23BrN2O3/c1-3-27-21(26)13-8-16-6-11-19(12-7-16)23-20(25)15-24(2)14-17-4-9-18(22)10-5-17/h4-13H,3,14-15H2,1-2H3,(H,23,25)/b13-8+