[4-[(4-methylphenyl)methoxy]phenyl]methyl-[3-(2-oxidanylideneazepan-1-yl)propyl]azanium

Systemtic Name: [4-[(4-methylphenyl)methoxy]phenyl]methyl-[3-(2-oxidanylideneazepan-1-yl)propyl]azanium Openeye Name: 3-(2-oxoazepan-1-yl)propyl-[[4-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: [4-[(4-methylphenyl)methoxy]phenyl]methyl-[3-(2-oxo-1-azepanyl)propyl]ammonium IUPAC Name: [4-[(4-methylphenyl)methoxy]phenyl]methyl-[3-(2-oxoazepan-1-yl)propyl]azanium Traditional Name: 3-(2-ketoazepan-1-yl)propyl-[4-(4-methylbenzyl)oxybenzyl]ammonium Formula: C24H33N2O2+ MolecularWeight: 381.53102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=C(C=C2)C[NH2+]CCCN3CCCCCC3=O

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=C(C=C2)C[NH2+]CCCN3CCCCCC3=O

InChI

InChI=1S/C24H32N2O2/c1-20-7-9-22(10-8-20)19-28-23-13-11-21(12-14-23)18-25-15-5-17-26-16-4-2-3-6-24(26)27/h7-14,25H,2-6,15-19H2,1H3/p+1