2-azanyl-2-[(2Z)-2-hydroxyimino-3-(1H-indol-3-yl)propanoyl]propanedioic acid

Systemtic Name: 2-azanyl-2-[(2Z)-2-hydroxyimino-3-(1H-indol-3-yl)propanoyl]propanedioic acid Openeye Name: 2-amino-2-[(2Z)-2-hydroxyimino-3-(1H-indol-3-yl)propanoyl]propanedioic acid CAS Name: 2-amino-2-[(2Z)-2-hydroxyimino-3-(1H-indol-3-yl)-1-oxopropyl]propanedioic acid IUPAC Name: 2-amino-2-[(2Z)-2-hydroxyimino-3-(1H-indol-3-yl)propanoyl]propanedioic acid Traditional Name: 2-amino-2-[(2Z)-2-hydroximino-3-(1H-indol-3-yl)propanoyl]malonic acid Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(=NO)C(=O)C(C(=O)O)(C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C/C(=N/O)/C(=O)C(C(=O)O)(C(=O)O)N

InChI

InChI=1S/C14H13N3O6/c15-14(12(19)20,13(21)22)11(18)10(17-23)5-7-6-16-9-4-2-1-3-8(7)9/h1-4,6,16,23H,5,15H2,(H,19,20)(H,21,22)/b17-10-