1-(anthracen-9-ylmethyl)-4-methyl-1,4-diazepan-1-ium

Systemtic Name: 1-(anthracen-9-ylmethyl)-4-methyl-1,4-diazepan-1-ium Openeye Name: 1-(9-anthrylmethyl)-4-methyl-1,4-diazepan-1-ium CAS Name: 1-(9-anthracenylmethyl)-4-methyl-1,4-diazepan-1-ium IUPAC Name: 1-(anthracen-9-ylmethyl)-4-methyl-1,4-diazepan-1-ium Traditional Name: 1-(9-anthrylmethyl)-4-methyl-1,4-diazepan-1-ium Formula: C21H25N2+ MolecularWeight: 305.4366

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC[NH+](CC1)CC2=C3C=CC=CC3=CC4=CC=CC=C42

Isomeric SMILES

CN1CCC[NH+](CC1)CC2=C3C=CC=CC3=CC4=CC=CC=C42

InChI

InChI=1S/C21H24N2/c1-22-11-6-12-23(14-13-22)16-21-19-9-4-2-7-17(19)15-18-8-3-5-10-20(18)21/h2-5,7-10,15H,6,11-14,16H2,1H3/p+1