1-methyl-3-[2-(3-methylimidazol-4-yl)ethynyl]indole-2-carbaldehyde

Systemtic Name: 1-methyl-3-[2-(3-methylimidazol-4-yl)ethynyl]indole-2-carbaldehyde Openeye Name: 1-methyl-3-[2-(3-methylimidazol-4-yl)ethynyl]indole-2-carbaldehyde CAS Name: 1-methyl-3-[2-(3-methyl-4-imidazolyl)ethynyl]-2-indolecarboxaldehyde IUPAC Name: 1-methyl-3-[2-(3-methylimidazol-4-yl)ethynyl]indole-2-carbaldehyde Traditional Name: 1-methyl-3-[2-(3-methylimidazol-4-yl)ethynyl]indole-2-carbaldehyde Formula: C16H13N3O MolecularWeight: 263.29392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C#CC2=C(N(C3=CC=CC=C32)C)C=O

Isomeric SMILES

CN1C=NC=C1C#CC2=C(N(C3=CC=CC=C32)C)C=O

InChI

InChI=1S/C16H13N3O/c1-18-11-17-9-12(18)7-8-14-13-5-3-4-6-15(13)19(2)16(14)10-20/h3-6,9-11H,1-2H3