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

Systemtic Name: 2-(1-butyl-5-cyano-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(1-butyl-5-cyano-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(1-butyl-5-cyano-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(1-butyl-5-cyano-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(1-butyl-5-cyano-8-ethyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3/c1-3-5-9-20(11-16(23)24)19-15(8-10-25-20)17-14(12-21)7-6-13(4-2)18(17)22-19/h6-7,22H,3-5,8-11H2,1-2H3,(H,23,24)