2-[(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)carbothioylamino]-4,5-dimethoxy-benzoic acid

Systemtic Name: 2-[(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)carbothioylamino]-4,5-dimethoxy-benzoic acid Openeye Name: 2-[(6-acetoxy-2,5,7,8-tetramethyl-chromane-2-carbothioyl)amino]-4,5-dimethoxy-benzoic acid CAS Name: 2-[[(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl)-sulfanylidenemethyl]amino]-4,5-dimethoxybenzoic acid IUPAC Name: 2-[(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydrochromene-2-carbothioyl)amino]-4,5-dimethoxybenzoic acid Traditional Name: 2-[(6-acetoxy-2,5,7,8-tetramethyl-chroman-2-carbothioyl)amino]-4,5-dimethoxy-benzoic acid Formula: C25H29NO7S MolecularWeight: 487.56526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)C(=S)NC3=CC(=C(C=C3C(=O)O)OC)OC

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)C(=S)NC3=CC(=C(C=C3C(=O)O)OC)OC

InChI

InChI=1S/C25H29NO7S/c1-12-13(2)22-16(14(3)21(12)32-15(4)27)8-9-25(5,33-22)24(34)26-18-11-20(31-7)19(30-6)10-17(18)23(28)29/h10-11H,8-9H2,1-7H3,(H,26,34)(H,28,29)