2-[(6-chloranyl-2-methyl-quinolin-3-yl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(6-chloranyl-2-methyl-quinolin-3-yl)carbonylamino]terephthalic acid Openeye Name: 2-[(6-chloro-2-methyl-quinoline-3-carbonyl)amino]terephthalic acid CAS Name: 2-[[(6-chloro-2-methyl-3-quinolinyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(6-chloro-2-methylquinoline-3-carbonyl)amino]terephthalic acid Traditional Name: 2-[(6-chloro-2-methyl-quinoline-3-carbonyl)amino]terephthalic acid Formula: C19H13ClN2O5 MolecularWeight: 384.76992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C19H13ClN2O5/c1-9-14(7-11-6-12(20)3-5-15(11)21-9)17(23)22-16-8-10(18(24)25)2-4-13(16)19(26)27/h2-8H,1H3,(H,22,23)(H,24,25)(H,26,27)