[2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-[(4-dimethylaminophenyl)methyl]-ethyl-azanium

Systemtic Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-[(4-dimethylaminophenyl)methyl]-ethyl-azanium Openeye Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-ethyl]-[(4-dimethylaminophenyl)methyl]-ethyl-ammonium CAS Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl]-[(4-dimethylaminophenyl)methyl]-ethylammonium IUPAC Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl]-[(4-dimethylaminophenyl)methyl]-ethylazanium Traditional Name: [4-(dimethylamino)benzyl]-ethyl-[2-keto-2-(veratrylamino)ethyl]ammonium Formula: C22H32N3O3+ MolecularWeight: 386.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC(=O)NCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC(=O)NCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H31N3O3/c1-6-25(15-17-7-10-19(11-8-17)24(2)3)16-22(26)23-14-18-9-12-20(27-4)21(13-18)28-5/h7-13H,6,14-16H2,1-5H3,(H,23,26)/p+1