1-naphthalen-2-yl-4-pyrrolidin-1-ium-1-yl-butan-1-one chloride

Systemtic Name: 1-naphthalen-2-yl-4-pyrrolidin-1-ium-1-yl-butan-1-one chloride Openeye Name: 1-(2-naphthyl)-4-pyrrolidin-1-ium-1-yl-butan-1-one chloride CAS Name: 1-(2-naphthalenyl)-4-(1-pyrrolidin-1-iumyl)-1-butanone chloride IUPAC Name: 1-naphthalen-2-yl-4-pyrrolidin-1-ium-1-ylbutan-1-one chloride Traditional Name: 1-(2-naphthyl)-4-pyrrolidin-1-ium-1-yl-butan-1-one chloride Formula: C18H22ClNO MolecularWeight: 303.82638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCC(=O)C2=CC3=CC=CC=C3C=C2.[Cl-]

Isomeric SMILES

C1CC[NH+](C1)CCCC(=O)C2=CC3=CC=CC=C3C=C2.[Cl-]

InChI

InChI=1S/C18H21NO.ClH/c20-18(8-5-13-19-11-3-4-12-19)17-10-9-15-6-1-2-7-16(15)14-17;/h1-2,6-7,9-10,14H,3-5,8,11-13H2;1H