(2R)-3-(4-chlorophenyl)-2-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]propanoate

Systemtic Name: (2R)-3-(4-chlorophenyl)-2-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]propanoate Openeye Name: (2R)-3-(4-chlorophenyl)-2-[[2-(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)acetyl]amino]propanoate CAS Name: (2R)-3-(4-chlorophenyl)-2-[[2-(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]amino]propanoate IUPAC Name: (2R)-3-(4-chlorophenyl)-2-[[2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetyl]amino]propanoate Traditional Name: (2R)-3-(4-chlorophenyl)-2-[[2-(7-hydroxy-2-keto-8-methyl-chromen-4-yl)acetyl]amino]propionate Formula: C21H17ClNO6- MolecularWeight: 414.81578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)[O-])O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)N[C@H](CC3=CC=C(C=C3)Cl)C(=O)[O-])O

InChI

InChI=1S/C21H18ClNO6/c1-11-17(24)7-6-15-13(10-19(26)29-20(11)15)9-18(25)23-16(21(27)28)8-12-2-4-14(22)5-3-12/h2-7,10,16,24H,8-9H2,1H3,(H,23,25)(H,27,28)/p-1/t16-/m1/s1