2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl-(1H-indol-3-ylmethyl)azanium

Systemtic Name: 2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl-(1H-indol-3-ylmethyl)azanium Openeye Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-(1H-indol-3-ylmethyl)ammonium CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]ethyl-(1H-indol-3-ylmethyl)ammonium IUPAC Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-(1H-indol-3-ylmethyl)azanium Traditional Name: 1H-indol-3-ylmethyl-[2-(veratroylamino)ethyl]ammonium Formula: C20H24N3O3+ MolecularWeight: 354.42286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=CNC3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=CNC3=CC=CC=C32)OC

InChI

InChI=1S/C20H23N3O3/c1-25-18-8-7-14(11-19(18)26-2)20(24)22-10-9-21-12-15-13-23-17-6-4-3-5-16(15)17/h3-8,11,13,21,23H,9-10,12H2,1-2H3,(H,22,24)/p+1