4-[(6-chloranylindol-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(6-chloranylindol-1-yl)methyl]benzoic acid Openeye Name: 4-[(6-chloroindol-1-yl)methyl]benzoic acid CAS Name: 4-[(6-chloro-1-indolyl)methyl]benzoic acid IUPAC Name: 4-[(6-chloroindol-1-yl)methyl]benzoic acid Traditional Name: 4-[(6-chloroindol-1-yl)methyl]benzoic acid Formula: C16H12ClNO2 MolecularWeight: 285.72498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CN2CC3=CC=C(C=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC2=C1C=CN2CC3=CC=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C16H12ClNO2/c17-14-6-5-12-7-8-18(15(12)9-14)10-11-1-3-13(4-2-11)16(19)20/h1-9H,10H2,(H,19,20)