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2-(azepin-1-yl)-2-oxidanylidene-ethanoic acid

2-(azepin-1-yl)-2-oxidanylidene-ethanoic acid

Systemtic Name:2-(azepin-1-yl)-2-oxidanylidene-ethanoic acid
Openeye Name:2-(azepin-1-yl)-2-oxo-acetic acid
CAS Name:2-(1-azepinyl)-2-oxoacetic acid
IUPAC Name:2-(azepin-1-yl)-2-oxoacetic acid
Traditional Name:2-(azepin-1-yl)-2-keto-acetic acid
Formula: C8H7NO3
MolecularWeight: 165.14608
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CN(C=C1)C(=O)C(=O)O


Isomeric SMILES

C1=CC=CN(C=C1)C(=O)C(=O)O


InChI

InChI=1S/C8H7NO3/c10-7(8(11)12)9-5-3-1-2-4-6-9/h1-6H,(H,11,12)


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