2-[2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-(4-chlorophenyl)propanoic acid

Systemtic Name: 2-[2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-(4-chlorophenyl)propanoic acid Openeye Name: 2-[[2-(4-butyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-3-(4-chlorophenyl)propanoic acid CAS Name: 2-[[2-[(4-butyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-3-(4-chlorophenyl)propanoic acid IUPAC Name: 2-[[2-(4-butyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(4-chlorophenyl)propanoic acid Traditional Name: 2-[[2-(4-butyl-2-keto-chromen-7-yl)oxyacetyl]amino]-3-(4-chlorophenyl)propionic acid Formula: C24H24ClNO6 MolecularWeight: 457.90346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C24H24ClNO6/c1-2-3-4-16-12-23(28)32-21-13-18(9-10-19(16)21)31-14-22(27)26-20(24(29)30)11-15-5-7-17(25)8-6-15/h5-10,12-13,20H,2-4,11,14H2,1H3,(H,26,27)(H,29,30)