(2-oxidanylidene-4-phenyl-chromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: (2-oxidanylidene-4-phenyl-chromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (2-oxo-4-phenyl-chromen-7-yl) 4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-phenylchromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 4-methyl-2-(tosylamino)valeric acid (2-keto-4-phenyl-chromen-7-yl) ester Formula: C28H27NO6S MolecularWeight: 505.58208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4

InChI

InChI=1S/C28H27NO6S/c1-18(2)15-25(29-36(32,33)22-12-9-19(3)10-13-22)28(31)34-21-11-14-23-24(20-7-5-4-6-8-20)17-27(30)35-26(23)16-21/h4-14,16-18,25,29H,15H2,1-3H3