methyl (E)-4-(4-bromophenyl)-3-(butylamino)but-2-enoate

Systemtic Name: methyl (E)-4-(4-bromophenyl)-3-(butylamino)but-2-enoate Openeye Name: methyl (E)-4-(4-bromophenyl)-3-(butylamino)but-2-enoate CAS Name: (E)-4-(4-bromophenyl)-3-(butylamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-(4-bromophenyl)-3-(butylamino)but-2-enoate Traditional Name: (E)-4-(4-bromophenyl)-3-(butylamino)but-2-enoic acid methyl ester Formula: C15H20BrNO2 MolecularWeight: 326.2288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrNO2/c1-3-4-9-17-14(11-15(18)19-2)10-12-5-7-13(16)8-6-12/h5-8,11,17H,3-4,9-10H2,1-2H3/b14-11+