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

Systemtic Name: 1-methyl-4-[(4-phenylphenyl)methyl]-1,4-diazepan-4-ium Openeye Name: 1-methyl-4-[(4-phenylphenyl)methyl]-1,4-diazepan-4-ium CAS Name: 1-methyl-4-[(4-phenylphenyl)methyl]-1,4-diazepan-4-ium IUPAC Name: 1-methyl-4-[(4-phenylphenyl)methyl]-1,4-diazepan-4-ium Traditional Name: 1-methyl-4-(4-phenylbenzyl)-1,4-diazepan-4-ium Formula: C19H25N2+ MolecularWeight: 281.4152

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC[NH+](CC1)CC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CN1CCC[NH+](CC1)CC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H24N2/c1-20-12-5-13-21(15-14-20)16-17-8-10-19(11-9-17)18-6-3-2-4-7-18/h2-4,6-11H,5,12-16H2,1H3/p+1