3-(2,7,8-trimethyl-5-nitro-6-oxidanyl-3,4-dihydrochromen-2-yl)propanoic acid

Systemtic Name: 3-(2,7,8-trimethyl-5-nitro-6-oxidanyl-3,4-dihydrochromen-2-yl)propanoic acid Openeye Name: 3-(6-hydroxy-2,7,8-trimethyl-5-nitro-chroman-2-yl)propanoic acid CAS Name: 3-(6-hydroxy-2,7,8-trimethyl-5-nitro-3,4-dihydro-2H-1-benzopyran-2-yl)propanoic acid IUPAC Name: 3-(6-hydroxy-2,7,8-trimethyl-5-nitro-3,4-dihydrochromen-2-yl)propanoic acid Traditional Name: 3-(6-hydroxy-2,7,8-trimethyl-5-nitro-chroman-2-yl)propionic acid Formula: C15H19NO6 MolecularWeight: 309.31446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(OC2=C1C)(C)CCC(=O)O)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C(=C2CCC(OC2=C1C)(C)CCC(=O)O)[N+](=O)[O-])O

InChI

InChI=1S/C15H19NO6/c1-8-9(2)14-10(12(13(8)19)16(20)21)4-6-15(3,22-14)7-5-11(17)18/h19H,4-7H2,1-3H3,(H,17,18)