N-(1,3-benzodioxol-5-yl)-3-morpholin-4-yl-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-morpholin-4-yl-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-morpholino-1,4-dioxo-naphthalene-2-sulfonamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(4-morpholinyl)-1,4-dioxo-2-naphthalenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-morpholin-4-yl-1,4-dioxonaphthalene-2-sulfonamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1,4-diketo-3-morpholino-naphthalene-2-sulfonamide Formula: C21H18N2O7S MolecularWeight: 442.44182

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCCN1C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H18N2O7S/c24-19-14-3-1-2-4-15(14)20(25)21(18(19)23-7-9-28-10-8-23)31(26,27)22-13-5-6-16-17(11-13)30-12-29-16/h1-6,11,22H,7-10,12H2