2-[4-(4-azanyl-3-methyl-phenyl)-1-methyl-1,4-diazepan-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(4-azanyl-3-methyl-phenyl)-1-methyl-1,4-diazepan-1-ium-1-yl]ethanol Openeye Name: 2-[4-(4-amino-3-methyl-phenyl)-1-methyl-1,4-diazepan-1-ium-1-yl]ethanol CAS Name: 2-[4-(4-amino-3-methylphenyl)-1-methyl-1,4-diazepan-1-ium-1-yl]ethanol IUPAC Name: 2-[4-(4-amino-3-methylphenyl)-1-methyl-1,4-diazepan-1-ium-1-yl]ethanol Traditional Name: 2-[4-(4-amino-3-methyl-phenyl)-1-methyl-1,4-diazepan-1-ium-1-yl]ethanol Formula: C15H26N3O+ MolecularWeight: 264.38644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCC[N+](CC2)(C)CCO)N

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCC[N+](CC2)(C)CCO)N

InChI

InChI=1S/C15H26N3O/c1-13-12-14(4-5-15(13)16)17-6-3-8-18(2,9-7-17)10-11-19/h4-5,12,19H,3,6-11,16H2,1-2H3/q+1