2-(8-methoxy-6-nitro-naphtho[2,1-g][1,3]benzodioxol-5-yl)ethanoic acid

Systemtic Name: 2-(8-methoxy-6-nitro-naphtho[2,1-g][1,3]benzodioxol-5-yl)ethanoic acid Openeye Name: 2-(8-methoxy-6-nitro-naphtho[2,1-g][1,3]benzodioxol-5-yl)acetic acid CAS Name: 2-(8-methoxy-6-nitro-5-naphtho[2,1-g][1,3]benzodioxolyl)acetic acid IUPAC Name: 2-(8-methoxy-6-nitronaphtho[2,1-g][1,3]benzodioxol-5-yl)acetic acid Traditional Name: 2-(8-methoxy-6-nitro-naphtho[2,1-g][1,3]benzodioxol-5-yl)acetic acid Formula: C18H13NO7 MolecularWeight: 355.29832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13NO7/c1-24-13-4-2-3-10-11(13)7-12(19(22)23)16-9(6-15(20)21)5-14-18(17(10)16)26-8-25-14/h2-5,7H,6,8H2,1H3,(H,20,21)