2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl-(furan-3-ylmethyl)azanium

Systemtic Name: 2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl-(furan-3-ylmethyl)azanium Openeye Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-(3-furylmethyl)ammonium CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]ethyl-(3-furanylmethyl)ammonium IUPAC Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-(furan-3-ylmethyl)azanium Traditional Name: 3-furfuryl-[2-(veratroylamino)ethyl]ammonium Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=COC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=COC=C2)OC

InChI

InChI=1S/C16H20N2O4/c1-20-14-4-3-13(9-15(14)21-2)16(19)18-7-6-17-10-12-5-8-22-11-12/h3-5,8-9,11,17H,6-7,10H2,1-2H3,(H,18,19)/p+1