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4-(carboxycarbonylamino)isoquinoline-3-carboxylic acid

4-(carboxycarbonylamino)isoquinoline-3-carboxylic acid

Systemtic Name:4-(carboxycarbonylamino)isoquinoline-3-carboxylic acid
Openeye Name:4-(oxaloamino)isoquinoline-3-carboxylic acid
CAS Name:4-(oxaloamino)-3-isoquinolinecarboxylic acid
IUPAC Name:4-(oxaloamino)isoquinoline-3-carboxylic acid
Traditional Name:4-(oxaloamino)isoquinoline-3-carboxylic acid
Formula: C12H8N2O5
MolecularWeight: 260.20232
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC(=C2NC(=O)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C=NC(=C2NC(=O)C(=O)O)C(=O)O


InChI

InChI=1S/C12H8N2O5/c15-10(12(18)19)14-8-7-4-2-1-3-6(7)5-13-9(8)11(16)17/h1-5H,(H,14,15)(H,16,17)(H,18,19)


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