1-[(4-methoxyphenyl)methyl]-4-methyl-1,4-diazepan-1-ium

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-4-methyl-1,4-diazepan-1-ium Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-methyl-1,4-diazepan-1-ium CAS Name: 1-[(4-methoxyphenyl)methyl]-4-methyl-1,4-diazepan-1-ium IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-methyl-1,4-diazepan-1-ium Traditional Name: 1-methyl-4-p-anisyl-1,4-diazepan-4-ium Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC[NH+](CC1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CN1CCC[NH+](CC1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C14H22N2O/c1-15-8-3-9-16(11-10-15)12-13-4-6-14(17-2)7-5-13/h4-7H,3,8-12H2,1-2H3/p+1