8-methoxy-6-nitro-9-oxidanyl-naphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid

Systemtic Name: 8-methoxy-6-nitro-9-oxidanyl-naphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid Openeye Name: 9-hydroxy-8-methoxy-6-nitro-naphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid CAS Name: 9-hydroxy-8-methoxy-6-nitro-5-naphtho[2,1-g][1,3]benzodioxolecarboxylic acid IUPAC Name: 9-hydroxy-8-methoxy-6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid Traditional Name: 9-hydroxy-8-methoxy-6-nitro-naphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid Formula: C17H11NO8 MolecularWeight: 357.27114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O)O

Isomeric SMILES

COC1=C(C=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O)O

InChI

InChI=1S/C17H11NO8/c1-24-15-8-4-10(18(22)23)13-9(17(20)21)5-12-16(26-6-25-12)14(13)7(8)2-3-11(15)19/h2-5,19H,6H2,1H3,(H,20,21)