(3-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (3-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (3-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (3-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (3-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (3-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C14H20N2O2/c1-15-7-4-8-16(10-9-15)14(17)12-5-3-6-13(11-12)18-2/h3,5-6,11H,4,7-10H2,1-2H3/p+1