2-(3-chloranyl-4-methyl-phenyl)-5,6,7,8-tetrahydroquinoline-5-carboxylic acid

Systemtic Name: 2-(3-chloranyl-4-methyl-phenyl)-5,6,7,8-tetrahydroquinoline-5-carboxylic acid Openeye Name: 2-(3-chloro-4-methyl-phenyl)-5,6,7,8-tetrahydroquinoline-5-carboxylic acid CAS Name: 2-(3-chloro-4-methylphenyl)-5,6,7,8-tetrahydroquinoline-5-carboxylic acid IUPAC Name: 2-(3-chloro-4-methylphenyl)-5,6,7,8-tetrahydroquinoline-5-carboxylic acid Traditional Name: 2-(3-chloro-4-methyl-phenyl)-5,6,7,8-tetrahydroquinoline-5-carboxylic acid Formula: C17H16ClNO2 MolecularWeight: 301.76744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(C=C2)C(CCC3)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=C2)C(CCC3)C(=O)O)Cl

InChI

InChI=1S/C17H16ClNO2/c1-10-5-6-11(9-14(10)18)15-8-7-12-13(17(20)21)3-2-4-16(12)19-15/h5-9,13H,2-4H2,1H3,(H,20,21)