4-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]butanoic acid

Systemtic Name: 4-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]butanoic acid Openeye Name: 4-[3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]butanoic acid CAS Name: 4-[[3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoylamino]butanoic acid Traditional Name: 4-[3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propanoylamino]butyric acid Formula: C18H21NO6 MolecularWeight: 347.36244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCCCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCCCC(=O)O

InChI

InChI=1S/C18H21NO6/c1-11-13-6-5-12(24-2)10-15(13)25-18(23)14(11)7-8-16(20)19-9-3-4-17(21)22/h5-6,10H,3-4,7-9H2,1-2H3,(H,19,20)(H,21,22)