(3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(4-propan-2-ylphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(4-propan-2-ylphenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-1-(4-isopropylphenyl)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione CAS Name: (3S)-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-(4-propan-2-ylphenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-(4-propan-2-ylphenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-p-cumenyl-pyrrolidine-2,5-quinone Formula: C24H30N3O3+ MolecularWeight: 408.5133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C24H29N3O3/c1-17(2)18-8-10-19(11-9-18)27-23(28)16-21(24(27)29)26-14-12-25(13-15-26)20-6-4-5-7-22(20)30-3/h4-11,17,21H,12-16H2,1-3H3/p+1/t21-/m0/s1