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2-(1H-indol-3-ylmethyl)propanedioic acid

2-(1H-indol-3-ylmethyl)propanedioic acid

Systemtic Name:2-(1H-indol-3-ylmethyl)propanedioic acid
Openeye Name:2-(1H-indol-3-ylmethyl)propanedioic acid
CAS Name:2-(1H-indol-3-ylmethyl)propanedioic acid
IUPAC Name:2-(1H-indol-3-ylmethyl)propanedioic acid
Traditional Name:2-(1H-indol-3-ylmethyl)malonic acid
Formula: C12H11NO4
MolecularWeight: 233.22004
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H11NO4/c14-11(15)9(12(16)17)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5H2,(H,14,15)(H,16,17)


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