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

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methyl-(3-oxidanylpropyl)azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)phenyl]methyl-(3-hydroxypropyl)ammonium CAS Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-(3-hydroxypropyl)ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-(3-hydroxypropyl)azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)benzyl]-(3-hydroxypropyl)ammonium Formula: C12H19N2O3+ MolecularWeight: 239.29086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH2+]CCCO)OCC(=O)N

Isomeric SMILES

C1=CC(=CC=C1C[NH2+]CCCO)OCC(=O)N

InChI

InChI=1S/C12H18N2O3/c13-12(16)9-17-11-4-2-10(3-5-11)8-14-6-1-7-15/h2-5,14-15H,1,6-9H2,(H2,13,16)/p+1