[3-(1,3-benzodioxol-5-yl)-1,2-oxazol-5-yl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-1,2-oxazol-5-yl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [3-(1,3-benzodioxol-5-yl)isoxazol-5-yl]methyl-(3-pyridylmethyl)ammonium CAS Name: [3-(1,3-benzodioxol-5-yl)-5-isoxazolyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [3-(1,3-benzodioxol-5-yl)-1,2-oxazol-5-yl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [3-(1,3-benzodioxol-5-yl)isoxazol-5-yl]methyl-(3-pyridylmethyl)ammonium Formula: C17H16N3O3+ MolecularWeight: 310.32724

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NOC(=C3)C[NH2+]CC4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NOC(=C3)C[NH2+]CC4=CN=CC=C4

InChI

InChI=1S/C17H15N3O3/c1-2-12(8-18-5-1)9-19-10-14-7-15(20-23-14)13-3-4-16-17(6-13)22-11-21-16/h1-8,19H,9-11H2/p+1