1-[(1R,2R)-3,3-dimethyl-6-nitro-2-oxidanyl-1,2-dihydroinden-1-yl]-5-methyl-pyrrolidin-2-one

Systemtic Name: 1-[(1R,2R)-3,3-dimethyl-6-nitro-2-oxidanyl-1,2-dihydroinden-1-yl]-5-methyl-pyrrolidin-2-one Openeye Name: 1-[(1R,2R)-2-hydroxy-3,3-dimethyl-6-nitro-indan-1-yl]-5-methyl-pyrrolidin-2-one CAS Name: 1-[(1R,2R)-2-hydroxy-3,3-dimethyl-6-nitro-1,2-dihydroinden-1-yl]-5-methyl-2-pyrrolidinone IUPAC Name: 1-[(1R,2R)-2-hydroxy-3,3-dimethyl-6-nitro-1,2-dihydroinden-1-yl]-5-methylpyrrolidin-2-one Traditional Name: 1-[(1R,2R)-2-hydroxy-3,3-dimethyl-6-nitro-indan-1-yl]-5-methyl-2-pyrrolidone Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)N1C2C(C(C3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O

Isomeric SMILES

CC1CCC(=O)N1[C@H]2[C@@H](C(C3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O

InChI

InChI=1S/C16H20N2O4/c1-9-4-7-13(19)17(9)14-11-8-10(18(21)22)5-6-12(11)16(2,3)15(14)20/h5-6,8-9,14-15,20H,4,7H2,1-3H3/t9?,14-,15+/m1/s1