2-[(6-chloranylindol-1-yl)methyl]benzoic acid

Systemtic Name: 2-[(6-chloranylindol-1-yl)methyl]benzoic acid Openeye Name: 2-[(6-chloroindol-1-yl)methyl]benzoic acid CAS Name: 2-[(6-chloro-1-indolyl)methyl]benzoic acid IUPAC Name: 2-[(6-chloroindol-1-yl)methyl]benzoic acid Traditional Name: 2-[(6-chloroindol-1-yl)methyl]benzoic acid Formula: C16H12ClNO2 MolecularWeight: 285.72498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC3=C2C=C(C=C3)Cl)C(=O)O

InChI

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