(E)-N-methyl-5-(1-oxidanidyl-5-propan-2-yloxy-pyridin-1-ium-2-yl)pent-4-en-2-amine

Systemtic Name: (E)-N-methyl-5-(1-oxidanidyl-5-propan-2-yloxy-pyridin-1-ium-2-yl)pent-4-en-2-amine Openeye Name: (E)-5-(5-isopropoxy-1-oxido-pyridin-1-ium-2-yl)-N-methyl-pent-4-en-2-amine CAS Name: (E)-N-methyl-5-(1-oxido-5-propan-2-yloxy-2-pyridin-1-iumyl)-4-penten-2-amine IUPAC Name: (E)-N-methyl-5-(1-oxido-5-propan-2-yloxypyridin-1-ium-2-yl)pent-4-en-2-amine Traditional Name: [(E)-4-(5-isopropoxy-1-oxido-pyridin-1-ium-2-yl)-1-methyl-but-3-enyl]-methyl-amine Formula: C14H22N2O2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C[N+](=C(C=C1)C=CCC(C)NC)[O-]

Isomeric SMILES

CC(C)OC1=C[N+](=C(C=C1)/C=C/CC(C)NC)[O-]

InChI

InChI=1S/C14H22N2O2/c1-11(2)18-14-9-8-13(16(17)10-14)7-5-6-12(3)15-4/h5,7-12,15H,6H2,1-4H3/b7-5+