(3R)-1-(2-methyl-4-oxidanyl-phenyl)-3-pyrrolidin-1-ium-1-yl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(2-methyl-4-oxidanyl-phenyl)-3-pyrrolidin-1-ium-1-yl-pyrrolidine-2,5-dione Openeye Name: (3R)-1-(4-hydroxy-2-methyl-phenyl)-3-pyrrolidin-1-ium-1-yl-pyrrolidine-2,5-dione CAS Name: (3R)-1-(4-hydroxy-2-methylphenyl)-3-(1-pyrrolidin-1-iumyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(4-hydroxy-2-methylphenyl)-3-pyrrolidin-1-ium-1-ylpyrrolidine-2,5-dione Traditional Name: (3R)-1-(4-hydroxy-2-methyl-phenyl)-3-pyrrolidin-1-ium-1-yl-pyrrolidine-2,5-quinone Formula: C15H19N2O3+ MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)N2C(=O)CC(C2=O)[NH+]3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)O)N2C(=O)C[C@H](C2=O)[NH+]3CCCC3

InChI

InChI=1S/C15H18N2O3/c1-10-8-11(18)4-5-12(10)17-14(19)9-13(15(17)20)16-6-2-3-7-16/h4-5,8,13,18H,2-3,6-7,9H2,1H3/p+1/t13-/m1/s1