cyanomethyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium

Systemtic Name: cyanomethyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium Openeye Name: cyanomethyl-[[5-(4-ethoxycarbonylphenyl)-2-furyl]methyl]ammonium CAS Name: cyanomethyl-[[5-(4-ethoxycarbonylphenyl)-2-furanyl]methyl]ammonium IUPAC Name: cyanomethyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium Traditional Name: [5-(4-carbethoxyphenyl)-2-furyl]methyl-(cyanomethyl)ammonium Formula: C16H17N2O3+ MolecularWeight: 285.31778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+]CC#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+]CC#N

InChI

InChI=1S/C16H16N2O3/c1-2-20-16(19)13-5-3-12(4-6-13)15-8-7-14(21-15)11-18-10-9-17/h3-8,18H,2,10-11H2,1H3/p+1