6-(2-phenylethynyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 6-(2-phenylethynyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(2-phenylethynyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-(2-phenylethynyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(2-phenylethynyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(2-phenylethynyl)-9H-$b-carboline-3-carboxylic acid Formula: C20H12N2O2 MolecularWeight: 312.32148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)NC4=CN=C(C=C34)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)NC4=CN=C(C=C34)C(=O)O

InChI

InChI=1S/C20H12N2O2/c23-20(24)18-11-16-15-10-14(7-6-13-4-2-1-3-5-13)8-9-17(15)22-19(16)12-21-18/h1-5,8-12,22H,(H,23,24)