methyl 4-methoxy-10-nitro-3,6-bis(oxidanyl)phenanthrene-1-carboxylate

Systemtic Name: methyl 4-methoxy-10-nitro-3,6-bis(oxidanyl)phenanthrene-1-carboxylate Openeye Name: methyl 3,6-dihydroxy-4-methoxy-10-nitro-phenanthrene-1-carboxylate CAS Name: 3,6-dihydroxy-4-methoxy-10-nitro-1-phenanthrenecarboxylic acid methyl ester IUPAC Name: methyl 3,6-dihydroxy-4-methoxy-10-nitrophenanthrene-1-carboxylate Traditional Name: 3,6-dihydroxy-4-methoxy-10-nitro-phenanthrene-1-carboxylic acid methyl ester Formula: C17H13NO7 MolecularWeight: 343.28762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=C(C=C3C=CC(=CC3=C21)O)[N+](=O)[O-])C(=O)OC)O

Isomeric SMILES

COC1=C(C=C(C2=C(C=C3C=CC(=CC3=C21)O)[N+](=O)[O-])C(=O)OC)O

InChI

InChI=1S/C17H13NO7/c1-24-16-13(20)7-11(17(21)25-2)14-12(18(22)23)5-8-3-4-9(19)6-10(8)15(14)16/h3-7,19-20H,1-2H3