methyl-[[4-[(4-methyl-1,4-diazepan-1-ium-1-yl)methyl]phenyl]methyl]azanium

Systemtic Name: methyl-[[4-[(4-methyl-1,4-diazepan-1-ium-1-yl)methyl]phenyl]methyl]azanium Openeye Name: methyl-[[4-[(4-methyl-1,4-diazepan-1-ium-1-yl)methyl]phenyl]methyl]ammonium CAS Name: methyl-[[4-[(4-methyl-1,4-diazepan-1-ium-1-yl)methyl]phenyl]methyl]ammonium IUPAC Name: methyl-[[4-[(4-methyl-1,4-diazepan-1-ium-1-yl)methyl]phenyl]methyl]azanium Traditional Name: methyl-[4-[(4-methyl-1,4-diazepan-1-ium-1-yl)methyl]benzyl]ammonium Formula: C15H27N3+2 MolecularWeight: 249.39498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC1=CC=C(C=C1)C[NH+]2CCCN(CC2)C

Isomeric SMILES

C[NH2+]CC1=CC=C(C=C1)C[NH+]2CCCN(CC2)C

InChI

InChI=1S/C15H25N3/c1-16-12-14-4-6-15(7-5-14)13-18-9-3-8-17(2)10-11-18/h4-7,16H,3,8-13H2,1-2H3/p+2