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

Systemtic Name: 2-(5-cyano-1-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(5-cyano-1-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(5-cyano-1-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(5-cyano-1-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(5-cyano-1-ethyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(CCO1)C3=C(C=CC=C3N2)C#N)CC(=O)O

Isomeric SMILES

CCC1(C2=C(CCO1)C3=C(C=CC=C3N2)C#N)CC(=O)O

InChI

InChI=1S/C16H16N2O3/c1-2-16(8-13(19)20)15-11(6-7-21-16)14-10(9-17)4-3-5-12(14)18-15/h3-5,18H,2,6-8H2,1H3,(H,19,20)