2-(1-butyl-5-cyano-8-fluoranyl-6-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid

Systemtic Name: 2-(1-butyl-5-cyano-8-fluoranyl-6-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(1-butyl-5-cyano-8-fluoro-6-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(1-butyl-5-cyano-8-fluoro-6-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(1-butyl-5-cyano-8-fluoro-6-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(1-butyl-5-cyano-8-fluoro-6-methyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C19H21FN2O3 MolecularWeight: 344.380043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C(CCO1)C3=C(C(=CC(=C3N2)F)C)C#N)CC(=O)O

Isomeric SMILES

CCCCC1(C2=C(CCO1)C3=C(C(=CC(=C3N2)F)C)C#N)CC(=O)O

InChI

InChI=1S/C19H21FN2O3/c1-3-4-6-19(9-15(23)24)18-12(5-7-25-19)16-13(10-21)11(2)8-14(20)17(16)22-18/h8,22H,3-7,9H2,1-2H3,(H,23,24)