5-chloranyl-1H-indole; 2,4-dimethylbenzoic acid

Systemtic Name: 5-chloranyl-1H-indole; 2,4-dimethylbenzoic acid Openeye Name: 5-chloro-1H-indole; 2,4-dimethylbenzoic acid CAS Name: 5-chloro-1H-indole; 2,4-dimethylbenzoic acid IUPAC Name: 5-chloro-1H-indole; 2,4-dimethylbenzoic acid Traditional Name: 5-chloro-1H-indole; 2,4-xylic acid Formula: C17H16ClNO2 MolecularWeight: 301.76744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)O)C.C1=CC2=C(C=CN2)C=C1Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)O)C.C1=CC2=C(C=CN2)C=C1Cl

InChI

InChI=1S/C9H10O2.C8H6ClN/c1-6-3-4-8(9(10)11)7(2)5-6;9-7-1-2-8-6(5-7)3-4-10-8/h3-5H,1-2H3,(H,10,11);1-5,10H