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

Systemtic Name: 2-[5,6,8-tris(chloranyl)-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-(5,6,8-trichloro-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(5,6,8-trichloro-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(5,6,8-trichloro-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(5,6,8-trichloro-1-propyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C16H16Cl3NO3 MolecularWeight: 376.66214

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C(CCO1)C3=C(N2)C(=CC(=C3Cl)Cl)Cl)CC(=O)O

Isomeric SMILES

CCCC1(C2=C(CCO1)C3=C(N2)C(=CC(=C3Cl)Cl)Cl)CC(=O)O

InChI

InChI=1S/C16H16Cl3NO3/c1-2-4-16(7-11(21)22)15-8(3-5-23-16)12-13(19)9(17)6-10(18)14(12)20-15/h6,20H,2-5,7H2,1H3,(H,21,22)