2-(3,4-dimethoxyphenyl)ethyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]ammonium CAS Name: [4-[anilino(oxo)methyl]phenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methylammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]azanium Traditional Name: homoveratryl-methyl-[4-(phenylcarbamoyl)benzyl]ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-27(16-15-19-11-14-23(29-2)24(17-19)30-3)18-20-9-12-21(13-10-20)25(28)26-22-7-5-4-6-8-22/h4-14,17H,15-16,18H2,1-3H3,(H,26,28)/p+1