1,4-diazepan-4-ium-1-yl-(4-dimethylaminophenyl)methanone

Systemtic Name: 1,4-diazepan-4-ium-1-yl-(4-dimethylaminophenyl)methanone Openeye Name: 1,4-diazepan-4-ium-1-yl-(4-dimethylaminophenyl)methanone CAS Name: 1,4-diazepan-4-ium-1-yl-(4-dimethylaminophenyl)methanone IUPAC Name: 1,4-diazepan-4-ium-1-yl-(4-dimethylaminophenyl)methanone Traditional Name: 1,4-diazepan-4-ium-1-yl-(4-dimethylaminophenyl)methanone Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCC[NH2+]CC2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCC[NH2+]CC2

InChI

InChI=1S/C14H21N3O/c1-16(2)13-6-4-12(5-7-13)14(18)17-10-3-8-15-9-11-17/h4-7,15H,3,8-11H2,1-2H3/p+1