2-(5-bromanyl-8-methyl-1-propyl-3,4-dihydro-[1]benzothiolo[2,3-c]pyran-1-yl)ethanoic acid

Systemtic Name: 2-(5-bromanyl-8-methyl-1-propyl-3,4-dihydro-[1]benzothiolo[2,3-c]pyran-1-yl)ethanoic acid Openeye Name: 2-(5-bromo-8-methyl-1-propyl-3,4-dihydrobenzothiopheno[2,3-c]pyran-1-yl)acetic acid CAS Name: 2-(5-bromo-8-methyl-1-propyl-3,4-dihydro-[1]benzothiolo[2,3-c]pyran-1-yl)acetic acid IUPAC Name: 2-(5-bromo-8-methyl-1-propyl-3,4-dihydro-[1]benzothiolo[2,3-c]pyran-1-yl)acetic acid Traditional Name: 2-(5-bromo-8-methyl-1-propyl-3,4-dihydrobenzothiopheno[2,3-c]pyran-1-yl)acetic acid Formula: C17H19BrO3S MolecularWeight: 383.29996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C(CCO1)C3=C(C=CC(=C3S2)C)Br)CC(=O)O

Isomeric SMILES

CCCC1(C2=C(CCO1)C3=C(C=CC(=C3S2)C)Br)CC(=O)O

InChI

InChI=1S/C17H19BrO3S/c1-3-7-17(9-13(19)20)16-11(6-8-21-17)14-12(18)5-4-10(2)15(14)22-16/h4-5H,3,6-9H2,1-2H3,(H,19,20)