[2-(cyclopentylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-(cyclopentylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-(cyclopentylamino)-2-oxo-1-(p-tolyl)ethyl]-methyl-ammonium CAS Name: [2-(cyclopentylamino)-1-(4-methylphenyl)-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-(cyclopentylamino)-1-(4-methylphenyl)-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-(cyclopentylamino)-2-keto-1-(p-tolyl)ethyl]-methyl-ammonium Formula: C22H29N2O+ MolecularWeight: 337.47846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)NC2CCCC2)[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)NC2CCCC2)[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O/c1-17-12-14-19(15-13-17)21(22(25)23-20-10-6-7-11-20)24(2)16-18-8-4-3-5-9-18/h3-5,8-9,12-15,20-21H,6-7,10-11,16H2,1-2H3,(H,23,25)/p+1