[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methyl-prop-2-ynyl-azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methyl-prop-2-ynyl-azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)phenyl]methyl-prop-2-ynyl-ammonium CAS Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-prop-2-ynylammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-prop-2-ynylazanium Traditional Name: [4-(2-amino-2-keto-ethoxy)benzyl]-propargyl-ammonium Formula: C12H15N2O2+ MolecularWeight: 219.2597

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Descriptors Computed from Structure

Canonical SMILES:

C#CC[NH2+]CC1=CC=C(C=C1)OCC(=O)N

Isomeric SMILES

C#CC[NH2+]CC1=CC=C(C=C1)OCC(=O)N

InChI

InChI=1S/C12H14N2O2/c1-2-7-14-8-10-3-5-11(6-4-10)16-9-12(13)15/h1,3-6,14H,7-9H2,(H2,13,15)/p+1