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benzene-1,3-dicarboxylic acid; N-methylmethanamine

benzene-1,3-dicarboxylic acid; N-methylmethanamine

Systemtic Name:benzene-1,3-dicarboxylic acid; N-methylmethanamine
Openeye Name:isophthalic acid; N-methylmethanamine
CAS Name:benzene-1,3-dicarboxylic acid; N-methylmethanamine
IUPAC Name:benzene-1,3-dicarboxylic acid; N-methylmethanamine
Traditional Name:dimethylamine; isophthalic acid
Formula: C10H13NO4
MolecularWeight: 211.21452
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Descriptors Computed from Structure

Canonical SMILES:

CNC.C1=CC(=CC(=C1)C(=O)O)C(=O)O


Isomeric SMILES

CNC.C1=CC(=CC(=C1)C(=O)O)C(=O)O


InChI

InChI=1S/C8H6O4.C2H7N/c9-7(10)5-2-1-3-6(4-5)8(11)12;1-3-2/h1-4H,(H,9,10)(H,11,12);3H,1-2H3


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