(3S,4R)-4-(diethylamino)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol

Systemtic Name: (3S,4R)-4-(diethylamino)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol Openeye Name: (3S,4R)-4-(diethylamino)-2,2-dimethyl-6-nitro-chroman-3-ol CAS Name: (3S,4R)-4-(diethylamino)-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: (3S,4R)-4-(diethylamino)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol Traditional Name: (3S,4R)-4-(diethylamino)-2,2-dimethyl-6-nitro-chroman-3-ol Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1C(C(OC2=C1C=C(C=C2)[N+](=O)[O-])(C)C)O

Isomeric SMILES

CCN(CC)[C@H]1[C@@H](C(OC2=C1C=C(C=C2)[N+](=O)[O-])(C)C)O

InChI

InChI=1S/C15H22N2O4/c1-5-16(6-2)13-11-9-10(17(19)20)7-8-12(11)21-15(3,4)14(13)18/h7-9,13-14,18H,5-6H2,1-4H3/t13-,14+/m1/s1