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

Systemtic Name: (3S)-6-azanyl-2,2-dimethyl-7-nitro-5-piperidin-1-yl-3,4-dihydrochromen-3-ol Openeye Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-(1-piperidyl)chroman-3-ol CAS Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-(1-piperidinyl)-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-piperidin-1-yl-3,4-dihydrochromen-3-ol Traditional Name: (3S)-6-amino-2,2-dimethyl-7-nitro-5-piperidino-chroman-3-ol Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=C(C(=C2N3CCCCC3)N)[N+](=O)[O-])O)C

Isomeric SMILES

CC1([C@H](CC2=C(O1)C=C(C(=C2N3CCCCC3)N)[N+](=O)[O-])O)C

InChI

InChI=1S/C16H23N3O4/c1-16(2)13(20)8-10-12(23-16)9-11(19(21)22)14(17)15(10)18-6-4-3-5-7-18/h9,13,20H,3-8,17H2,1-2H3/t13-/m0/s1