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

Systemtic Name: 2-[8-chloranyl-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C17H17ClF3NO3 MolecularWeight: 375.76999

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C(CCO1)C3=C(C=CC(=C3N2)Cl)C(F)(F)F)CC(=O)O

Isomeric SMILES

CCCC1(C2=C(CCO1)C3=C(C=CC(=C3N2)Cl)C(F)(F)F)CC(=O)O

InChI

InChI=1S/C17H17ClF3NO3/c1-2-6-16(8-12(23)24)15-9(5-7-25-16)13-10(17(19,20)21)3-4-11(18)14(13)22-15/h3-4,22H,2,5-8H2,1H3,(H,23,24)