2,3-dimethylaniline; 4-[(2,3-dimethylphenyl)carbamoyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 2,3-dimethylaniline; 4-[(2,3-dimethylphenyl)carbamoyl]benzene-1,3-dicarboxylic acid Openeye Name: 2,3-dimethylaniline; 4-[(2,3-dimethylphenyl)carbamoyl]benzene-1,3-dicarboxylic acid CAS Name: 2,3-dimethylaniline; 4-[(2,3-dimethylanilino)-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 2,3-dimethylaniline; 4-[(2,3-dimethylphenyl)carbamoyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-[(2,3-dimethylphenyl)carbamoyl]isophthalic acid; 2,3-xylidine Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N)C.CC1=C(C(=CC=C1)NC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N)C.CC1=C(C(=CC=C1)NC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O)C

InChI

InChI=1S/C17H15NO5.C8H11N/c1-9-4-3-5-14(10(9)2)18-15(19)12-7-6-11(16(20)21)8-13(12)17(22)23;1-6-4-3-5-8(9)7(6)2/h3-8H,1-2H3,(H,18,19)(H,20,21)(H,22,23);3-5H,9H2,1-2H3