[(1S)-1-[2,4-bis(oxidanyl)phenyl]ethyl]-prop-2-ynyl-azanium

Systemtic Name: [(1S)-1-[2,4-bis(oxidanyl)phenyl]ethyl]-prop-2-ynyl-azanium Openeye Name: [(1S)-1-(2,4-dihydroxyphenyl)ethyl]-prop-2-ynyl-ammonium CAS Name: [(1S)-1-(2,4-dihydroxyphenyl)ethyl]-prop-2-ynylammonium IUPAC Name: [(1S)-1-(2,4-dihydroxyphenyl)ethyl]-prop-2-ynylazanium Traditional Name: [(1S)-1-(2,4-dihydroxyphenyl)ethyl]-propargyl-ammonium Formula: C11H14NO2+ MolecularWeight: 192.23436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO2/c1-3-6-12-8(2)10-5-4-9(13)7-11(10)14/h1,4-5,7-8,12-14H,6H2,2H3/p+1/t8-/m0/s1