2-chloranyl-4-(1H-indol-6-ylmethylcarbamoyl)benzoic acid

Systemtic Name: 2-chloranyl-4-(1H-indol-6-ylmethylcarbamoyl)benzoic acid Openeye Name: 2-chloro-4-(1H-indol-6-ylmethylcarbamoyl)benzoic acid CAS Name: 2-chloro-4-[(1H-indol-6-ylmethylamino)-oxomethyl]benzoic acid IUPAC Name: 2-chloro-4-(1H-indol-6-ylmethylcarbamoyl)benzoic acid Traditional Name: 2-chloro-4-(1H-indol-6-ylmethylcarbamoyl)benzoic acid Formula: C17H13ClN2O3 MolecularWeight: 328.74972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CN2)CNC(=O)C3=CC(=C(C=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC2=C1C=CN2)CNC(=O)C3=CC(=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C17H13ClN2O3/c18-14-8-12(3-4-13(14)17(22)23)16(21)20-9-10-1-2-11-5-6-19-15(11)7-10/h1-8,19H,9H2,(H,20,21)(H,22,23)