[(2S)-2-(1,3-benzodioxol-5-yl)-2-oxidanyl-ethyl]-prop-2-enyl-azanium

Systemtic Name: [(2S)-2-(1,3-benzodioxol-5-yl)-2-oxidanyl-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(2S)-2-(1,3-benzodioxol-5-yl)-2-hydroxy-ethyl]ammonium CAS Name: [(2S)-2-(1,3-benzodioxol-5-yl)-2-hydroxyethyl]-prop-2-enylammonium IUPAC Name: [(2S)-2-(1,3-benzodioxol-5-yl)-2-hydroxyethyl]-prop-2-enylazanium Traditional Name: allyl-[(2S)-2-(1,3-benzodioxol-5-yl)-2-hydroxy-ethyl]ammonium Formula: C12H16NO3+ MolecularWeight: 222.26034

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH2+]CC(C1=CC2=C(C=C1)OCO2)O

Isomeric SMILES

C=CC[NH2+]C[C@H](C1=CC2=C(C=C1)OCO2)O

InChI

InChI=1S/C12H15NO3/c1-2-5-13-7-10(14)9-3-4-11-12(6-9)16-8-15-11/h2-4,6,10,13-14H,1,5,7-8H2/p+1/t10-/m1/s1