4-(4-azanyl-3-methyl-phenyl)-1,1-dimethyl-1,4-diazepan-1-ium-6-ol

Systemtic Name: 4-(4-azanyl-3-methyl-phenyl)-1,1-dimethyl-1,4-diazepan-1-ium-6-ol Openeye Name: 4-(4-amino-3-methyl-phenyl)-1,1-dimethyl-1,4-diazepan-1-ium-6-ol CAS Name: 4-(4-amino-3-methylphenyl)-1,1-dimethyl-1,4-diazepan-1-ium-6-ol IUPAC Name: 4-(4-amino-3-methylphenyl)-1,1-dimethyl-1,4-diazepan-1-ium-6-ol Traditional Name: 4-(4-amino-3-methyl-phenyl)-1,1-dimethyl-1,4-diazepan-1-ium-6-ol Formula: C14H24N3O+ MolecularWeight: 250.35986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[N+](CC(C2)O)(C)C)N

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[N+](CC(C2)O)(C)C)N

InChI

InChI=1S/C14H24N3O/c1-11-8-12(4-5-14(11)15)16-6-7-17(2,3)10-13(18)9-16/h4-5,8,13,18H,6-7,9-10,15H2,1-3H3/q+1