1,4-dimethyl-6-phenyl-2,3-dihydro-1,4-diazepin-1-ium

Systemtic Name: 1,4-dimethyl-6-phenyl-2,3-dihydro-1,4-diazepin-1-ium Openeye Name: 1,4-dimethyl-6-phenyl-2,3-dihydro-1,4-diazepin-1-ium CAS Name: 1,4-dimethyl-6-phenyl-2,3-dihydro-1,4-diazepin-1-ium IUPAC Name: 1,4-dimethyl-6-phenyl-2,3-dihydro-1,4-diazepin-1-ium Traditional Name: 1,4-dimethyl-6-phenyl-2,3-dihydro-1,4-diazepin-1-ium Formula: C13H17N2+ MolecularWeight: 201.28748

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=CC(=C1)C2=CC=CC=C2)C

Isomeric SMILES

CN1CC[N+](=CC(=C1)C2=CC=CC=C2)C

InChI

InChI=1S/C13H17N2/c1-14-8-9-15(2)11-13(10-14)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3/q+1