[3-(2-azanyl-2-oxidanylidene-ethoxy)-4-methoxy-phenyl]methyl-phenethyl-azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethoxy)-4-methoxy-phenyl]methyl-phenethyl-azanium Openeye Name: [3-(2-amino-2-oxo-ethoxy)-4-methoxy-phenyl]methyl-phenethyl-ammonium CAS Name: [3-(2-amino-2-oxoethoxy)-4-methoxyphenyl]methyl-phenethylammonium IUPAC Name: [3-(2-amino-2-oxoethoxy)-4-methoxyphenyl]methyl-phenethylazanium Traditional Name: [3-(2-amino-2-keto-ethoxy)-4-methoxy-benzyl]-phenethyl-ammonium Formula: C18H23N2O3+ MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CCC2=CC=CC=C2)OCC(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CCC2=CC=CC=C2)OCC(=O)N

InChI

InChI=1S/C18H22N2O3/c1-22-16-8-7-15(11-17(16)23-13-18(19)21)12-20-10-9-14-5-3-2-4-6-14/h2-8,11,20H,9-10,12-13H2,1H3,(H2,19,21)/p+1