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

Systemtic Name: 2-(5-cyano-1-cyclobutyl-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(5-cyano-1-cyclobutyl-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(5-cyano-1-cyclobutyl-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(5-cyano-1-cyclobutyl-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(5-cyano-1-cyclobutyl-8-methyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C#N)C3=C(N2)C(OCC3)(CC(=O)O)C4CCC4

Isomeric SMILES

CC1=C2C(=C(C=C1)C#N)C3=C(N2)C(OCC3)(CC(=O)O)C4CCC4

InChI

InChI=1S/C19H20N2O3/c1-11-5-6-12(10-20)16-14-7-8-24-19(9-15(22)23,13-3-2-4-13)18(14)21-17(11)16/h5-6,13,21H,2-4,7-9H2,1H3,(H,22,23)