4-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperazine-1-carbaldehyde Openeye Name: 4-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperazine-1-carbaldehyde CAS Name: 4-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperazine-1-carbaldehyde Traditional Name: 4-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonyl]piperazine-1-carbaldehyde Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

C1CN(CCN1C=O)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C12H13N3O5S/c16-8-14-3-5-15(6-4-14)21(18,19)9-1-2-10-11(7-9)20-12(17)13-10/h1-2,7-8H,3-6H2,(H,13,17)