[3-methoxy-4-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl-(2-methylpropyl)azanium

Systemtic Name: [3-methoxy-4-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl-(2-methylpropyl)azanium Openeye Name: isobutyl-[[3-methoxy-4-[2-(2-methylanilino)-2-oxo-ethoxy]phenyl]methyl]ammonium CAS Name: [3-methoxy-4-[2-(2-methylanilino)-2-oxoethoxy]phenyl]methyl-(2-methylpropyl)ammonium IUPAC Name: [3-methoxy-4-[2-(2-methylanilino)-2-oxoethoxy]phenyl]methyl-(2-methylpropyl)azanium Traditional Name: isobutyl-[4-[2-keto-2-(o-toluidino)ethoxy]-3-methoxy-benzyl]ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2)C[NH2+]CC(C)C)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2)C[NH2+]CC(C)C)OC

InChI

InChI=1S/C21H28N2O3/c1-15(2)12-22-13-17-9-10-19(20(11-17)25-4)26-14-21(24)23-18-8-6-5-7-16(18)3/h5-11,15,22H,12-14H2,1-4H3,(H,23,24)/p+1