2-[(1R,3S)-1-methyl-9-oxidanyl-10-oxidanylidene-1,3,4,5-tetrahydrobenzo[g]isochromen-3-yl]ethanoic acid

Systemtic Name: 2-[(1R,3S)-1-methyl-9-oxidanyl-10-oxidanylidene-1,3,4,5-tetrahydrobenzo[g]isochromen-3-yl]ethanoic acid Openeye Name: 2-[(1R,3S)-9-hydroxy-1-methyl-10-oxo-1,3,4,5-tetrahydrobenzo[g]isochromen-3-yl]acetic acid CAS Name: 2-[(1R,3S)-9-hydroxy-1-methyl-10-oxo-1,3,4,5-tetrahydrobenzo[g][2]benzopyran-3-yl]acetic acid IUPAC Name: 2-[(1R,3S)-9-hydroxy-1-methyl-10-oxo-1,3,4,5-tetrahydrobenzo[g]isochromen-3-yl]acetic acid Traditional Name: 2-[(1R,3S)-9-hydroxy-10-keto-1-methyl-1,3,4,5-tetrahydrobenz[g]isochromen-3-yl]acetic acid Formula: C16H16O5 MolecularWeight: 288.29524

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CC(O1)CC(=O)O)CC3=C(C2=O)C(=CC=C3)O

Isomeric SMILES

C[C@@H]1C2=C(C[C@H](O1)CC(=O)O)CC3=C(C2=O)C(=CC=C3)O

InChI

InChI=1S/C16H16O5/c1-8-14-10(6-11(21-8)7-13(18)19)5-9-3-2-4-12(17)15(9)16(14)20/h2-4,8,11,17H,5-7H2,1H3,(H,18,19)/t8-,11+/m1/s1