methyl 6-[2-[4-(N'-methylcarbamimidoyl)phenyl]phenoxy]hexanoate

Systemtic Name: methyl 6-[2-[4-(N'-methylcarbamimidoyl)phenyl]phenoxy]hexanoate Openeye Name: methyl 6-[2-[4-(N'-methylcarbamimidoyl)phenyl]phenoxy]hexanoate CAS Name: 6-[2-[4-[amino(methylimino)methyl]phenyl]phenoxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[2-[4-(N'-methylcarbamimidoyl)phenyl]phenoxy]hexanoate Traditional Name: 6-[2-[4-(N'-methylamidino)phenyl]phenoxy]hexanoic acid methyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C(C1=CC=C(C=C1)C2=CC=CC=C2OCCCCCC(=O)OC)N

Isomeric SMILES

CN=C(C1=CC=C(C=C1)C2=CC=CC=C2OCCCCCC(=O)OC)N

InChI

InChI=1S/C21H26N2O3/c1-23-21(22)17-13-11-16(12-14-17)18-8-5-6-9-19(18)26-15-7-3-4-10-20(24)25-2/h5-6,8-9,11-14H,3-4,7,10,15H2,1-2H3,(H2,22,23)