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

Systemtic Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-ethyl]-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: (4-isopropylbenzyl)-[2-keto-2-(veratrylamino)ethyl]-methyl-ammonium Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3/c1-16(2)19-9-6-17(7-10-19)14-24(3)15-22(25)23-13-18-8-11-20(26-4)21(12-18)27-5/h6-12,16H,13-15H2,1-5H3,(H,23,25)/p+1