[3,4-bis(oxidanyl)phenyl]methyl-prop-2-ynyl-azanium

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-prop-2-ynyl-azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-prop-2-ynyl-ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-prop-2-ynylammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-prop-2-ynylazanium Traditional Name: propargyl(protocatechuyl)ammonium Formula: C10H12NO2+ MolecularWeight: 178.20778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO2/c1-2-5-11-7-8-3-4-9(12)10(13)6-8/h1,3-4,6,11-13H,5,7H2/p+1