(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate CAS Name: 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Traditional Name: 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]valeric acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C27H30F3NO6S MolecularWeight: 553.59041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(CC(C)C)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(CC(C)C)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(C)C

InChI

InChI=1S/C27H30F3NO6S/c1-15(2)9-23(31-38(34,35)20-8-6-7-19(12-20)27(28,29)30)26(33)36-14-18-11-25(32)37-24-10-17(5)21(16(3)4)13-22(18)24/h6-8,10-13,15-16,23,31H,9,14H2,1-5H3