1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium

Systemtic Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium Openeye Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium CAS Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium IUPAC Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium Traditional Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C[NH+]3CCCCC3

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C[NH+]3CCCCC3

InChI

InChI=1S/C14H19NO3/c1-16-12-7-11(8-13-14(12)18-10-17-13)9-15-5-3-2-4-6-15/h7-8H,2-6,9-10H2,1H3/p+1