1-[(3S)-6-azanyl-2,2-dimethyl-7-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one

Systemtic Name: 1-[(3S)-6-azanyl-2,2-dimethyl-7-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Openeye Name: 1-[(3S)-6-amino-3-hydroxy-2,2-dimethyl-7-nitro-chroman-4-yl]pyrrolidin-2-one CAS Name: 1-[(3S)-6-amino-3-hydroxy-2,2-dimethyl-7-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pyrrolidinone IUPAC Name: 1-[(3S)-6-amino-3-hydroxy-2,2-dimethyl-7-nitro-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Traditional Name: 1-[(3S)-6-amino-3-hydroxy-2,2-dimethyl-7-nitro-chroman-4-yl]-2-pyrrolidone Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=CC(=C(C=C2O1)[N+](=O)[O-])N)N3CCCC3=O)O)C

Isomeric SMILES

CC1([C@H](C(C2=CC(=C(C=C2O1)[N+](=O)[O-])N)N3CCCC3=O)O)C

InChI

InChI=1S/C15H19N3O5/c1-15(2)14(20)13(17-5-3-4-12(17)19)8-6-9(16)10(18(21)22)7-11(8)23-15/h6-7,13-14,20H,3-5,16H2,1-2H3/t13?,14-/m0/s1