3-methyl-2-[2-[2-[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]ethanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-[2-[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]ethanoylamino]butanoic acid Openeye Name: 2-[[2-[[2-(3-benzyl-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-butanoic acid CAS Name: 3-methyl-2-[[2-[[2-[[4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]butanoic acid IUPAC Name: 2-[[2-[[2-(3-benzyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[[2-(3-benzyl-2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-butyric acid Formula: C26H28N2O7 MolecularWeight: 480.50972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O7/c1-15(2)24(25(31)32)28-22(29)13-27-23(30)14-34-18-9-10-19-16(3)20(26(33)35-21(19)12-18)11-17-7-5-4-6-8-17/h4-10,12,15,24H,11,13-14H2,1-3H3,(H,27,30)(H,28,29)(H,31,32)