4-[(1-methylpiperazin-1-ium-1-yl)methyl]-1-(phenylmethyl)pyrrolidin-2-one

Systemtic Name: 4-[(1-methylpiperazin-1-ium-1-yl)methyl]-1-(phenylmethyl)pyrrolidin-2-one Openeye Name: 1-benzyl-4-[(1-methylpiperazin-1-ium-1-yl)methyl]pyrrolidin-2-one CAS Name: 4-[(1-methyl-1-piperazin-1-iumyl)methyl]-1-(phenylmethyl)-2-pyrrolidinone IUPAC Name: 1-benzyl-4-[(1-methylpiperazin-1-ium-1-yl)methyl]pyrrolidin-2-one Traditional Name: 1-benzyl-4-[(1-methylpiperazin-1-ium-1-yl)methyl]-2-pyrrolidone Formula: C17H26N3O+ MolecularWeight: 288.40784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)CC2CC(=O)N(C2)CC3=CC=CC=C3

Isomeric SMILES

C[N+]1(CCNCC1)CC2CC(=O)N(C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H26N3O/c1-20(9-7-18-8-10-20)14-16-11-17(21)19(13-16)12-15-5-3-2-4-6-15/h2-6,16,18H,7-14H2,1H3/q+1