4-[3-(1-methylbenzimidazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]butanoic acid

Systemtic Name: 4-[3-(1-methylbenzimidazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]butanoic acid Openeye Name: 4-[7-hydroxy-3-(1-methylbenzimidazol-2-yl)-4-oxo-chromen-2-yl]butanoic acid CAS Name: 4-[7-hydroxy-3-(1-methyl-2-benzimidazolyl)-4-oxo-1-benzopyran-2-yl]butanoic acid IUPAC Name: 4-[7-hydroxy-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-2-yl]butanoic acid Traditional Name: 4-[7-hydroxy-4-keto-3-(1-methylbenzimidazol-2-yl)chromen-2-yl]butyric acid Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C3=C(OC4=C(C3=O)C=CC(=C4)O)CCCC(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C3=C(OC4=C(C3=O)C=CC(=C4)O)CCCC(=O)O

InChI

InChI=1S/C21H18N2O5/c1-23-15-6-3-2-5-14(15)22-21(23)19-16(7-4-8-18(25)26)28-17-11-12(24)9-10-13(17)20(19)27/h2-3,5-6,9-11,24H,4,7-8H2,1H3,(H,25,26)