2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl-[(3-phenoxyphenyl)methyl]azanium

Systemtic Name: 2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl-[(3-phenoxyphenyl)methyl]azanium Openeye Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-[(3-phenoxyphenyl)methyl]ammonium CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]ethyl-[(3-phenoxyphenyl)methyl]ammonium IUPAC Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-[(3-phenoxyphenyl)methyl]azanium Traditional Name: (3-phenoxybenzyl)-[2-(veratroylamino)ethyl]ammonium Formula: C24H27N2O4+ MolecularWeight: 407.48218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=CC(=CC=C2)OC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=CC(=CC=C2)OC3=CC=CC=C3)OC

InChI

InChI=1S/C24H26N2O4/c1-28-22-12-11-19(16-23(22)29-2)24(27)26-14-13-25-17-18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-12,15-16,25H,13-14,17H2,1-2H3,(H,26,27)/p+1