(4S)-1-[(2R)-1-methoxypropan-2-yl]-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: (4S)-1-[(2R)-1-methoxypropan-2-yl]-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: (4S)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-[(1R)-2-methoxy-1-methyl-ethyl]pyrrolidin-2-one CAS Name: (4S)-1-[(2R)-1-methoxypropan-2-yl]-4-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-2-pyrrolidinone IUPAC Name: (4S)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-[(2R)-1-methoxypropan-2-yl]pyrrolidin-2-one Traditional Name: (4S)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-[(1R)-2-methoxy-1-methyl-ethyl]-2-pyrrolidone Formula: C20H30N3O3+ MolecularWeight: 360.4705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1CC(CC1=O)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](COC)N1C[C@H](CC1=O)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H29N3O3/c1-16(15-26-2)23-14-18(12-19(23)24)20(25)22-10-8-21(9-11-22)13-17-6-4-3-5-7-17/h3-7,16,18H,8-15H2,1-2H3/p+1/t16-,18+/m1/s1