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

Systemtic Name: 2-[5-cyano-1-(methoxymethyl)-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[5-cyano-1-(methoxymethyl)-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[5-cyano-1-(methoxymethyl)-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[5-cyano-1-(methoxymethyl)-8-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[5-cyano-1-(methoxymethyl)-8-methyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C17H18N2O4 MolecularWeight: 314.33582

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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)COC

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O4/c1-10-3-4-11(8-18)14-12-5-6-23-17(9-22-2,7-13(20)21)16(12)19-15(10)14/h3-4,19H,5-7,9H2,1-2H3,(H,20,21)