[4-(4-benzamidophenyl)-4-oxidanylidene-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-(4-benzamidophenyl)-4-oxidanylidene-1-phosphono-butyl]phosphonic acid Openeye Name: [4-(4-benzamidophenyl)-4-oxo-1-phosphono-butyl]phosphonic acid CAS Name: [4-(4-benzamidophenyl)-4-oxo-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-(4-benzamidophenyl)-4-oxo-1-phosphonobutyl]phosphonic acid Traditional Name: [4-(4-benzamidophenyl)-4-keto-1-phosphono-butyl]phosphonic acid Formula: C17H19NO8P2 MolecularWeight: 427.282182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)CCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)CCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C17H19NO8P2/c19-15(10-11-16(27(21,22)23)28(24,25)26)12-6-8-14(9-7-12)18-17(20)13-4-2-1-3-5-13/h1-9,16H,10-11H2,(H,18,20)(H2,21,22,23)(H2,24,25,26)