(3S)-6-azanyl-2,2-dimethyl-7-nitro-5-pyrrolidin-1-yl-3,4-dihydrochromen-3-ol

Systemtic Name: (3S)-6-azanyl-2,2-dimethyl-7-nitro-5-pyrrolidin-1-yl-3,4-dihydrochromen-3-ol Openeye Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-pyrrolidin-1-yl-chroman-3-ol CAS Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-(1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-pyrrolidin-1-yl-3,4-dihydrochromen-3-ol Traditional Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-pyrrolidino-chroman-3-ol Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=C(C(=C2N3CCCC3)N)[N+](=O)[O-])O)C

Isomeric SMILES

CC1([C@H](CC2=C(O1)C=C(C(=C2N3CCCC3)N)[N+](=O)[O-])O)C

InChI

InChI=1S/C15H21N3O4/c1-15(2)12(19)7-9-11(22-15)8-10(18(20)21)13(16)14(9)17-5-3-4-6-17/h8,12,19H,3-7,16H2,1-2H3/t12-/m0/s1