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

Systemtic Name: 4-[2-[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]butanoic acid Openeye Name: 4-[[2-(3-benzyl-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]butanoic acid CAS Name: 4-[[2-[[4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(3-benzyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid Traditional Name: 4-[[2-(3-benzyl-2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]butyric acid Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23NO6/c1-15-18-10-9-17(29-14-21(25)24-11-5-8-22(26)27)13-20(18)30-23(28)19(15)12-16-6-3-2-4-7-16/h2-4,6-7,9-10,13H,5,8,11-12,14H2,1H3,(H,24,25)(H,26,27)