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

Systemtic Name: (4-ethoxyphenyl)methyl-[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethyl]azanium Openeye Name: (4-ethoxyphenyl)methyl-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]ammonium CAS Name: (4-ethoxyphenyl)methyl-[2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]ethyl]ammonium IUPAC Name: (4-ethoxyphenyl)methyl-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]azanium Traditional Name: (4-ethoxybenzyl)-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]ammonium Formula: C21H29N2O5+ MolecularWeight: 389.46536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH2+]CCNC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH2+]CCNC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C21H28N2O5/c1-5-28-17-8-6-15(7-9-17)14-22-10-11-23-21(24)16-12-18(25-2)20(27-4)19(13-16)26-3/h6-9,12-13,22H,5,10-11,14H2,1-4H3,(H,23,24)/p+1