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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N[C@H](CC3=CC=C(C=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C21H18ClNO6/c1-11-15-7-6-14(24)9-18(15)29-21(28)16(11)10-19(25)23-17(20(26)27)8-12-2-4-13(22)5-3-12/h2-7,9,17,24H,8,10H2,1H3,(H,23,25)(H,26,27)/p-1/t17-/m1/s1