6-chloranyl-3-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-3-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one Openeye Name: 6-chloro-3-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 6-chloro-3-[2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-3-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-1,3-benzoxazol-2-one Traditional Name: 6-chloro-3-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-keto-ethyl]-1,3-benzoxazol-2-one Formula: C21H22ClN3O7S MolecularWeight: 495.93328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C4=C(C=C(C=C4)Cl)OC3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C4=C(C=C(C=C4)Cl)OC3=O)OC

InChI

InChI=1S/C21H22ClN3O7S/c1-30-17-6-4-15(12-19(17)31-2)33(28,29)24-9-7-23(8-10-24)20(26)13-25-16-5-3-14(22)11-18(16)32-21(25)27/h3-6,11-12H,7-10,13H2,1-2H3