methyl 6-[3-(6-methoxy-6-oxidanylidene-hexyl)-2-oxidanylidene-benzimidazol-1-yl]hexanoate

Systemtic Name: methyl 6-[3-(6-methoxy-6-oxidanylidene-hexyl)-2-oxidanylidene-benzimidazol-1-yl]hexanoate Openeye Name: methyl 6-[3-(6-methoxy-6-oxo-hexyl)-2-oxo-benzimidazol-1-yl]hexanoate CAS Name: 6-[3-(6-methoxy-6-oxohexyl)-2-oxo-1-benzimidazolyl]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(6-methoxy-6-oxohexyl)-2-oxobenzimidazol-1-yl]hexanoate Traditional Name: 6-[2-keto-3-(6-keto-6-methoxy-hexyl)benzimidazol-1-yl]hexanoic acid methyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCN1C2=CC=CC=C2N(C1=O)CCCCCC(=O)OC

Isomeric SMILES

COC(=O)CCCCCN1C2=CC=CC=C2N(C1=O)CCCCCC(=O)OC

InChI

InChI=1S/C21H30N2O5/c1-27-19(24)13-5-3-9-15-22-17-11-7-8-12-18(17)23(21(22)26)16-10-4-6-14-20(25)28-2/h7-8,11-12H,3-6,9-10,13-16H2,1-2H3