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3-[azanyl(cyano)methyl]benzoic acid

3-[azanyl(cyano)methyl]benzoic acid

Systemtic Name:3-[azanyl(cyano)methyl]benzoic acid
Openeye Name:3-[amino(cyano)methyl]benzoic acid
CAS Name:3-[amino(cyano)methyl]benzoic acid
IUPAC Name:3-[amino(cyano)methyl]benzoic acid
Traditional Name:3-[amino(cyano)methyl]benzoic acid
Formula: C9H8N2O2
MolecularWeight: 176.17202
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(C#N)N)C(=O)O


Isomeric SMILES

C1=CC(=CC(=C1)C(C#N)N)C(=O)O


InChI

InChI=1S/C9H8N2O2/c10-5-8(11)6-2-1-3-7(4-6)9(12)13/h1-4,8H,11H2,(H,12,13)


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