2-[5,6,8-tris(chloranyl)-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid

Systemtic Name: 2-[5,6,8-tris(chloranyl)-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-(5,6,8-trichloro-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(5,6,8-trichloro-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(5,6,8-trichloro-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(5,6,8-trichloro-1-methyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C14H12Cl3NO3 MolecularWeight: 348.60898

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(CCO1)C3=C(N2)C(=CC(=C3Cl)Cl)Cl)CC(=O)O

Isomeric SMILES

CC1(C2=C(CCO1)C3=C(N2)C(=CC(=C3Cl)Cl)Cl)CC(=O)O

InChI

InChI=1S/C14H12Cl3NO3/c1-14(5-9(19)20)13-6(2-3-21-14)10-11(17)7(15)4-8(16)12(10)18-13/h4,18H,2-3,5H2,1H3,(H,19,20)