methyl 4-(2-pyridin-3-yl-1H-indol-3-yl)but-2-ynoate

Systemtic Name: methyl 4-(2-pyridin-3-yl-1H-indol-3-yl)but-2-ynoate Openeye Name: methyl 4-[2-(3-pyridyl)-1H-indol-3-yl]but-2-ynoate CAS Name: 4-[2-(3-pyridinyl)-1H-indol-3-yl]-2-butynoic acid methyl ester IUPAC Name: methyl 4-(2-pyridin-3-yl-1H-indol-3-yl)but-2-ynoate Traditional Name: 4-[2-(3-pyridyl)-1H-indol-3-yl]but-2-ynoic acid methyl ester Formula: C18H14N2O2 MolecularWeight: 290.31596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCC1=C(NC2=CC=CC=C21)C3=CN=CC=C3

Isomeric SMILES

COC(=O)C#CCC1=C(NC2=CC=CC=C21)C3=CN=CC=C3

InChI

InChI=1S/C18H14N2O2/c1-22-17(21)10-4-8-15-14-7-2-3-9-16(14)20-18(15)13-6-5-11-19-12-13/h2-3,5-7,9,11-12,20H,8H2,1H3