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

Systemtic Name: 2-(8-chloranyl-5-iodanyl-6-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(8-chloro-5-iodo-6-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(8-chloro-5-iodo-6-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(8-chloro-5-iodo-6-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(8-chloro-5-iodo-6-methyl-1-propyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C17H19ClINO3 MolecularWeight: 447.69513

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClINO3/c1-3-5-17(8-12(21)22)16-10(4-6-23-17)13-14(19)9(2)7-11(18)15(13)20-16/h7,20H,3-6,8H2,1-2H3,(H,21,22)