2-[(4-methylphenyl)amino]-5-phenylazanyl-terephthalic acid

Systemtic Name: 2-[(4-methylphenyl)amino]-5-phenylazanyl-terephthalic acid Openeye Name: 2-anilino-5-(4-methylanilino)terephthalic acid CAS Name: 2-anilino-5-(4-methylanilino)terephthalic acid IUPAC Name: 2-anilino-5-(4-methylanilino)terephthalic acid Traditional Name: 2-anilino-5-(p-toluidino)terephthalic acid Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H18N2O4/c1-13-7-9-15(10-8-13)23-19-12-16(20(24)25)18(11-17(19)21(26)27)22-14-5-3-2-4-6-14/h2-12,22-23H,1H3,(H,24,25)(H,26,27)