(4-methyl-2-oxidanylidene-chromen-7-yl) 3-[(4-chlorophenyl)sulfonyl-(3,5-dimethylphenyl)amino]propanoate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 3-[(4-chlorophenyl)sulfonyl-(3,5-dimethylphenyl)amino]propanoate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 3-(N-(4-chlorophenyl)sulfonyl-3,5-dimethyl-anilino)propanoate CAS Name: 3-(N-(4-chlorophenyl)sulfonyl-3,5-dimethylanilino)propanoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 3-(N-(4-chlorophenyl)sulfonyl-3,5-dimethylanilino)propanoate Traditional Name: 3-(N-(4-chlorophenyl)sulfonyl-3,5-dimethyl-anilino)propionic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C27H24ClNO6S MolecularWeight: 526.00056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C)S(=O)(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C)S(=O)(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C27H24ClNO6S/c1-17-12-18(2)14-21(13-17)29(36(32,33)23-7-4-20(28)5-8-23)11-10-26(30)34-22-6-9-24-19(3)15-27(31)35-25(24)16-22/h4-9,12-16H,10-11H2,1-3H3