2-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]-4-oxidanyl-3H-1-benzofuran-7-carboxylic acid

Systemtic Name: 2-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]-4-oxidanyl-3H-1-benzofuran-7-carboxylic acid Openeye Name: 4-hydroxy-2-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]-3H-benzofuran-7-carboxylic acid CAS Name: 4-hydroxy-2-methyl-2-[(1S)-4-methyl-1-cyclohex-3-enyl]-3H-benzofuran-7-carboxylic acid IUPAC Name: 4-hydroxy-2-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]-3H-1-benzofuran-7-carboxylic acid Traditional Name: 4-hydroxy-2-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]coumaran-7-carboxylic acid Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)C2(CC3=C(C=CC(=C3O2)C(=O)O)O)C

Isomeric SMILES

CC1=CC[C@H](CC1)C2(CC3=C(C=CC(=C3O2)C(=O)O)O)C

InChI

InChI=1S/C17H20O4/c1-10-3-5-11(6-4-10)17(2)9-13-14(18)8-7-12(16(19)20)15(13)21-17/h3,7-8,11,18H,4-6,9H2,1-2H3,(H,19,20)/t11-,17?/m1/s1