5,7-bis(cyclopropylsulfanyl)-9H-xanthene-2-carboxylic acid

Systemtic Name: 5,7-bis(cyclopropylsulfanyl)-9H-xanthene-2-carboxylic acid Openeye Name: 5,7-bis(cyclopropylsulfanyl)-9H-xanthene-2-carboxylic acid CAS Name: 5,7-bis(cyclopropylthio)-9H-xanthene-2-carboxylic acid IUPAC Name: 5,7-bis(cyclopropylsulfanyl)-9H-xanthene-2-carboxylic acid Traditional Name: 5,7-bis(cyclopropylthio)-9H-xanthene-2-carboxylic acid Formula: C20H18O3S2 MolecularWeight: 370.48512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1SC2=CC(=C3C(=C2)CC4=C(O3)C=CC(=C4)C(=O)O)SC5CC5

Isomeric SMILES

C1CC1SC2=CC(=C3C(=C2)CC4=C(O3)C=CC(=C4)C(=O)O)SC5CC5

InChI

InChI=1S/C20H18O3S2/c21-20(22)11-1-6-17-12(7-11)8-13-9-16(24-14-2-3-14)10-18(19(13)23-17)25-15-4-5-15/h1,6-7,9-10,14-15H,2-5,8H2,(H,21,22)