(3-bromophenyl)methyl-[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethyl]azanium

Systemtic Name: (3-bromophenyl)methyl-[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethyl]azanium Openeye Name: (3-bromophenyl)methyl-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]ammonium CAS Name: (3-bromophenyl)methyl-[2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]ethyl]ammonium IUPAC Name: (3-bromophenyl)methyl-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]azanium Traditional Name: (3-bromobenzyl)-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]ammonium Formula: C19H24BrN2O4+ MolecularWeight: 424.30886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC[NH2+]CC2=CC(=CC=C2)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC[NH2+]CC2=CC(=CC=C2)Br

InChI

InChI=1S/C19H23BrN2O4/c1-24-16-10-14(11-17(25-2)18(16)26-3)19(23)22-8-7-21-12-13-5-4-6-15(20)9-13/h4-6,9-11,21H,7-8,12H2,1-3H3,(H,22,23)/p+1