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

Systemtic Name: methyl 4-(3-methyl-2-pyridin-3-yl-indol-1-yl)but-2-ynoate Openeye Name: methyl 4-[3-methyl-2-(3-pyridyl)indol-1-yl]but-2-ynoate CAS Name: 4-[3-methyl-2-(3-pyridinyl)-1-indolyl]-2-butynoic acid methyl ester IUPAC Name: methyl 4-(3-methyl-2-pyridin-3-ylindol-1-yl)but-2-ynoate Traditional Name: 4-[3-methyl-2-(3-pyridyl)indol-1-yl]but-2-ynoic acid methyl ester Formula: C19H16N2O2 MolecularWeight: 304.34254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)CC#CC(=O)OC)C3=CN=CC=C3

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)CC#CC(=O)OC)C3=CN=CC=C3

InChI

InChI=1S/C19H16N2O2/c1-14-16-8-3-4-9-17(16)21(12-6-10-18(22)23-2)19(14)15-7-5-11-20-13-15/h3-5,7-9,11,13H,12H2,1-2H3