thiophen-2-ylmethyl-[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethyl]azanium

Systemtic Name: thiophen-2-ylmethyl-[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethyl]azanium Openeye Name: 2-thienylmethyl-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]ammonium CAS Name: 2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]ethyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: thiophen-2-ylmethyl-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]azanium Traditional Name: 2-thenyl-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]ammonium Formula: C17H23N2O4S+ MolecularWeight: 351.44052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC[NH2+]CC2=CC=CS2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC[NH2+]CC2=CC=CS2

InChI

InChI=1S/C17H22N2O4S/c1-21-14-9-12(10-15(22-2)16(14)23-3)17(20)19-7-6-18-11-13-5-4-8-24-13/h4-5,8-10,18H,6-7,11H2,1-3H3,(H,19,20)/p+1