8-chloranyl-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indole-1-carboxylic acid

Systemtic Name: 8-chloranyl-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indole-1-carboxylic acid Openeye Name: 8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indole-1-carboxylic acid CAS Name: 8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indole-1-carboxylic acid IUPAC Name: 8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indole-1-carboxylic acid Traditional Name: 8-chloro-1-propyl-5-(trifluoromethyl)-4,9-dihydro-3H-pyran[3,4-b]indole-1-carboxylic acid Formula: C16H15ClF3NO3 MolecularWeight: 361.74341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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