1-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]-1,4-diazepan-1-ium

Systemtic Name: 1-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]-1,4-diazepan-1-ium Openeye Name: 1-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-1,4-diazepan-1-ium CAS Name: 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1,4-diazepan-1-ium IUPAC Name: 1-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]-1,4-diazepan-1-ium Traditional Name: 1-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-1,4-diazepan-1-ium Formula: C14H24N3O+ MolecularWeight: 250.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1OC)C)C[NH+]2CCCNCC2

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)C[NH+]2CCCNCC2

InChI

InChI=1S/C14H23N3O/c1-11-9-16-13(12(2)14(11)18-3)10-17-7-4-5-15-6-8-17/h9,15H,4-8,10H2,1-3H3/p+1