2-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethyl-(2-hydroxyethyl)-dimethyl-azanium

Systemtic Name: 2-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethyl-(2-hydroxyethyl)-dimethyl-azanium Openeye Name: 2-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethyl-(2-hydroxyethyl)-dimethyl-ammonium CAS Name: 2-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethyl-(2-hydroxyethyl)-dimethylammonium IUPAC Name: 2-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethyl-(2-hydroxyethyl)-dimethylazanium Traditional Name: 2-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethyl-(2-hydroxyethyl)-dimethyl-ammonium Formula: C17H31N4O+ MolecularWeight: 307.45424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCN1CCCN(CC1)C2=CC=C(C=C2)N)CCO

Isomeric SMILES

C[N+](C)(CCN1CCCN(CC1)C2=CC=C(C=C2)N)CCO

InChI

InChI=1S/C17H31N4O/c1-21(2,14-15-22)13-12-19-8-3-9-20(11-10-19)17-6-4-16(18)5-7-17/h4-7,22H,3,8-15,18H2,1-2H3/q+1