(4R)-1-propan-2-yl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-pyrrolidin-2-one

Systemtic Name: (4R)-1-propan-2-yl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-pyrrolidin-2-one Openeye Name: (4R)-1-isopropyl-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one CAS Name: (4R)-4-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-1-propan-2-yl-2-pyrrolidinone IUPAC Name: (4R)-1-propan-2-yl-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one Traditional Name: (4R)-1-isopropyl-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-2-pyrrolidone Formula: C17H25N4O2+ MolecularWeight: 317.406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1=O)C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC(C)N1C[C@@H](CC1=O)C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C17H24N4O2/c1-13(2)21-12-14(11-16(21)22)17(23)20-9-7-19(8-10-20)15-5-3-4-6-18-15/h3-6,13-14H,7-12H2,1-2H3/p+1/t14-/m1/s1