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

Systemtic Name: 2-(1-ethyl-4,5,8-trimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(1-ethyl-4,5,8-trimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(1-ethyl-4,5,8-trimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(1-ethyl-4,5,8-trimethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(1-ethyl-4,5,8-trimethyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(C(CO1)C)C3=C(C=CC(=C3N2)C)C)CC(=O)O

Isomeric SMILES

CCC1(C2=C(C(CO1)C)C3=C(C=CC(=C3N2)C)C)CC(=O)O

InChI

InChI=1S/C18H23NO3/c1-5-18(8-13(20)21)17-15(12(4)9-22-18)14-10(2)6-7-11(3)16(14)19-17/h6-7,12,19H,5,8-9H2,1-4H3,(H,20,21)