[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: [4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (3-benzyl-4-methyl-2-oxo-chromen-7-yl) 3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid [4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-4-methyl-2-oxochromen-7-yl) 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 3-methyl-2-(tosylamino)butyric acid (3-benzyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C29H29NO6S MolecularWeight: 519.60866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC2=CC3=C(C=C2)C(=C(C(=O)O3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC2=CC3=C(C=C2)C(=C(C(=O)O3)CC4=CC=CC=C4)C

InChI

InChI=1S/C29H29NO6S/c1-18(2)27(30-37(33,34)23-13-10-19(3)11-14-23)29(32)35-22-12-15-24-20(4)25(28(31)36-26(24)17-22)16-21-8-6-5-7-9-21/h5-15,17-18,27,30H,16H2,1-4H3