4-[3-(3-azanyl-4-pyrrolidin-1-yl-phenyl)propanoylamino]butyl-dimethyl-azanium

Systemtic Name: 4-[3-(3-azanyl-4-pyrrolidin-1-yl-phenyl)propanoylamino]butyl-dimethyl-azanium Openeye Name: 4-[3-(3-amino-4-pyrrolidin-1-yl-phenyl)propanoylamino]butyl-dimethyl-ammonium CAS Name: 4-[[3-[3-amino-4-(1-pyrrolidinyl)phenyl]-1-oxopropyl]amino]butyl-dimethylammonium IUPAC Name: 4-[3-(3-amino-4-pyrrolidin-1-ylphenyl)propanoylamino]butyl-dimethylazanium Traditional Name: 4-[3-(3-amino-4-pyrrolidino-phenyl)propanoylamino]butyl-dimethyl-ammonium Formula: C19H33N4O+ MolecularWeight: 333.49152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCCNC(=O)CCC1=CC(=C(C=C1)N2CCCC2)N

Isomeric SMILES

C[NH+](C)CCCCNC(=O)CCC1=CC(=C(C=C1)N2CCCC2)N

InChI

InChI=1S/C19H32N4O/c1-22(2)12-4-3-11-21-19(24)10-8-16-7-9-18(17(20)15-16)23-13-5-6-14-23/h7,9,15H,3-6,8,10-14,20H2,1-2H3,(H,21,24)/p+1