7-ethoxycarbonyl-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-5-ium-8-sulfonic acid

Systemtic Name: 7-ethoxycarbonyl-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-5-ium-8-sulfonic acid Openeye Name: 7-ethoxycarbonyl-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-5-ium-8-sulfonic acid CAS Name: 7-ethoxycarbonyl-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-5-ium-8-sulfonic acid IUPAC Name: 7-ethoxycarbonyl-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-5-ium-8-sulfonic acid Traditional Name: 7-carbethoxy-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-5-ium-8-sulfonic acid Formula: C15H16NO7S+ MolecularWeight: 354.35504

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC(=C(C2=CC3=C(C=C21)OCO3)S(=O)(=O)O)C(=O)OCC

Isomeric SMILES

CC[N+]1=CC(=C(C2=CC3=C(C=C21)OCO3)S(=O)(=O)O)C(=O)OCC

InChI

InChI=1S/C15H15NO7S/c1-3-16-7-10(15(17)21-4-2)14(24(18,19)20)9-5-12-13(6-11(9)16)23-8-22-12/h5-7H,3-4,8H2,1-2H3/p+1