2-[[6,7-bis(chloranyl)-2-cyclopentyl-2-methyl-1-oxidanylidene-3H-inden-5-yl]sulfanyl-cyclopentylcarbonyl-amino]pentanedioic acid

Systemtic Name: 2-[[6,7-bis(chloranyl)-2-cyclopentyl-2-methyl-1-oxidanylidene-3H-inden-5-yl]sulfanyl-cyclopentylcarbonyl-amino]pentanedioic acid Openeye Name: 2-[cyclopentanecarbonyl-(6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-indan-5-yl)sulfanyl-amino]pentanedioic acid CAS Name: 2-[[cyclopentyl(oxo)methyl]-[(6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-3H-inden-5-yl)thio]amino]pentanedioic acid IUPAC Name: 2-[cyclopentanecarbonyl-[(6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-3H-inden-5-yl)sulfanyl]amino]pentanedioic acid Traditional Name: 2-[cyclopentanecarbonyl-[(6,7-dichloro-2-cyclopentyl-1-keto-2-methyl-indan-5-yl)thio]amino]glutaric acid Formula: C26H31Cl2NO6S MolecularWeight: 556.49844

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)SN(C(CCC(=O)O)C(=O)O)C(=O)C3CCCC3)C4CCCC4

Isomeric SMILES

CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)SN(C(CCC(=O)O)C(=O)O)C(=O)C3CCCC3)C4CCCC4

InChI

InChI=1S/C26H31Cl2NO6S/c1-26(16-8-4-5-9-16)13-15-12-18(21(27)22(28)20(15)23(26)32)36-29(24(33)14-6-2-3-7-14)17(25(34)35)10-11-19(30)31/h12,14,16-17H,2-11,13H2,1H3,(H,30,31)(H,34,35)