(2S)-2-[2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[2-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-phenyl-propionic acid Formula: C23H22N2O7 MolecularWeight: 438.42998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O7/c1-14-9-22(28)32-19-11-16(7-8-17(14)19)31-13-21(27)24-12-20(26)25-18(23(29)30)10-15-5-3-2-4-6-15/h2-9,11,18H,10,12-13H2,1H3,(H,24,27)(H,25,26)(H,29,30)/t18-/m0/s1