[2-[(3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[(3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[(3,4-dimethoxyphenyl)methyl-(2-furylmethyl)amino]-2-oxo-ethyl]ammonium CAS Name: [2-[(3,4-dimethoxyphenyl)methyl-(2-furanylmethyl)amino]-2-oxoethyl]ammonium IUPAC Name: [2-[(3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)amino]-2-oxoethyl]azanium Traditional Name: [2-[2-furfuryl(veratryl)amino]-2-keto-ethyl]ammonium Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C(=O)C[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C(=O)C[NH3+])OC

InChI

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