O1-carboxy O3-(phenylmethyl) 2-[(2Z)-2-carboxyoxy-2-hydroxyimino-ethyl]propanedioate

Systemtic Name: O1-carboxy O3-(phenylmethyl) 2-[(2Z)-2-carboxyoxy-2-hydroxyimino-ethyl]propanedioate Openeye Name: O1-benzyl O3-carboxy 2-[(2Z)-2-carboxyoxy-2-hydroxyimino-ethyl]propanedioate CAS Name: 2-[(2Z)-2-carboxyoxy-2-hydroxyiminoethyl]propanedioic acid O1-carboxy ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-carboxy 2-[(2Z)-2-carboxyoxy-2-hydroxyiminoethyl]propanedioate Traditional Name: 2-[(2Z)-2-carboxyoxy-2-hydroximino-ethyl]malonic acid O1-benzyl ester O3-carboxy ester Formula: C14H13NO10 MolecularWeight: 355.25372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC(=NO)OC(=O)O)C(=O)OC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(C/C(=N/O)/OC(=O)O)C(=O)OC(=O)O

InChI

InChI=1S/C14H13NO10/c16-11(23-7-8-4-2-1-3-5-8)9(12(17)25-14(20)21)6-10(15-22)24-13(18)19/h1-5,9,22H,6-7H2,(H,18,19)(H,20,21)/b15-10-