4-[6-ethyl-3-(1-methylbenzimidazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]butanoic acid

Systemtic Name: 4-[6-ethyl-3-(1-methylbenzimidazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]butanoic acid Openeye Name: 4-[6-ethyl-7-hydroxy-3-(1-methylbenzimidazol-2-yl)-4-oxo-chromen-2-yl]butanoic acid CAS Name: 4-[6-ethyl-7-hydroxy-3-(1-methyl-2-benzimidazolyl)-4-oxo-1-benzopyran-2-yl]butanoic acid IUPAC Name: 4-[6-ethyl-7-hydroxy-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-2-yl]butanoic acid Traditional Name: 4-[6-ethyl-7-hydroxy-4-keto-3-(1-methylbenzimidazol-2-yl)chromen-2-yl]butyric acid Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)CCCC(=O)O)C3=NC4=CC=CC=C4N3C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)CCCC(=O)O)C3=NC4=CC=CC=C4N3C)O

InChI

InChI=1S/C23H22N2O5/c1-3-13-11-14-19(12-17(13)26)30-18(9-6-10-20(27)28)21(22(14)29)23-24-15-7-4-5-8-16(15)25(23)2/h4-5,7-8,11-12,26H,3,6,9-10H2,1-2H3,(H,27,28)