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

Systemtic Name: 2-[8-chloranyl-1-ethyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[8-chloro-1-ethyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[8-chloro-1-ethyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[8-chloro-1-ethyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[8-chloro-1-ethyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C16H15ClF3NO3 MolecularWeight: 361.74341

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(CCO1)C3=C(C=CC(=C3N2)Cl)C(F)(F)F)CC(=O)O

Isomeric SMILES

CCC1(C2=C(CCO1)C3=C(C=CC(=C3N2)Cl)C(F)(F)F)CC(=O)O

InChI

InChI=1S/C16H15ClF3NO3/c1-2-15(7-11(22)23)14-8(5-6-24-15)12-9(16(18,19)20)3-4-10(17)13(12)21-14/h3-4,21H,2,5-7H2,1H3,(H,22,23)