[4-(azepan-1-ylsulfonyl)phenyl]-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]azanide

Systemtic Name: [4-(azepan-1-ylsulfonyl)phenyl]-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]azanide Openeye Name: [4-(azepan-1-ylsulfonyl)phenyl]-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]azanide CAS Name: [4-(1-azepanylsulfonyl)phenyl]-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]azanide IUPAC Name: [4-(azepan-1-ylsulfonyl)phenyl]-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]azanide Traditional Name: [4-(azepan-1-ylsulfonyl)phenyl]-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]azanide Formula: C20H22N3O6S2- MolecularWeight: 464.53518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)[N-]C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)[N-]C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4)OC1=O

InChI

InChI=1S/C20H22N3O6S2/c1-22-18-11-10-17(14-19(18)29-20(22)24)30(25,26)21-15-6-8-16(9-7-15)31(27,28)23-12-4-2-3-5-13-23/h6-11,14H,2-5,12-13H2,1H3/q-1