(3-benzamido-4-oxidanylidene-4-phenyl-1-phosphono-butyl)phosphonic acid

Systemtic Name: (3-benzamido-4-oxidanylidene-4-phenyl-1-phosphono-butyl)phosphonic acid Openeye Name: (3-benzamido-4-oxo-4-phenyl-1-phosphono-butyl)phosphonic acid CAS Name: (3-benzamido-4-oxo-4-phenyl-1-phosphonobutyl)phosphonic acid IUPAC Name: (3-benzamido-4-oxo-4-phenyl-1-phosphonobutyl)phosphonic acid Traditional Name: (3-benzamido-4-keto-4-phenyl-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)C(CC(P(=O)(O)O)P(=O)(O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(CC(P(=O)(O)O)P(=O)(O)O)NC(=O)C2=CC=CC=C2

InChI

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