2-(3,4-dimethoxyphenyl)ethyl-[2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(benzhydrylamino)-2-oxo-ethyl]-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-[(diphenylmethyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: [2-(benzhydrylamino)-2-oxoethyl]-[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium Traditional Name: [2-(benzhydrylamino)-2-keto-ethyl]-homoveratryl-methyl-ammonium Formula: C26H31N2O3+ MolecularWeight: 419.53594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H30N2O3/c1-28(17-16-20-14-15-23(30-2)24(18-20)31-3)19-25(29)27-26(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-15,18,26H,16-17,19H2,1-3H3,(H,27,29)/p+1