(3S,4R)-4-(2,5-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol

Systemtic Name: (3S,4R)-4-(2,5-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol Openeye Name: (3S,4R)-4-(2,5-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-chroman-3-ol CAS Name: (3S,4R)-4-(2,5-dimethyl-1-pyrrolidinyl)-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: (3S,4R)-4-(2,5-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol Traditional Name: (3S,4R)-4-(2,5-dimethylpyrrolidino)-2,2-dimethyl-6-nitro-chroman-3-ol Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N1C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O)C

Isomeric SMILES

CC1CCC(N1[C@H]2[C@@H](C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O)C

InChI

InChI=1S/C17H24N2O4/c1-10-5-6-11(2)18(10)15-13-9-12(19(21)22)7-8-14(13)23-17(3,4)16(15)20/h7-11,15-16,20H,5-6H2,1-4H3/t10?,11?,15-,16+/m1/s1