2-[5,6-dibutoxy-2-oxidanylidene-3-(phenylmethyl)benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[5,6-dibutoxy-2-oxidanylidene-3-(phenylmethyl)benzimidazol-1-yl]ethanoic acid Openeye Name: 2-(3-benzyl-5,6-dibutoxy-2-oxo-benzimidazol-1-yl)acetic acid CAS Name: 2-[5,6-dibutoxy-2-oxo-3-(phenylmethyl)-1-benzimidazolyl]acetic acid IUPAC Name: 2-(3-benzyl-5,6-dibutoxy-2-oxobenzimidazol-1-yl)acetic acid Traditional Name: 2-(3-benzyl-5,6-dibutoxy-2-keto-benzimidazol-1-yl)acetic acid Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1)N(C(=O)N2CC(=O)O)CC3=CC=CC=C3)OCCCC

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)N(C(=O)N2CC(=O)O)CC3=CC=CC=C3)OCCCC

InChI

InChI=1S/C24H30N2O5/c1-3-5-12-30-21-14-19-20(15-22(21)31-13-6-4-2)26(17-23(27)28)24(29)25(19)16-18-10-8-7-9-11-18/h7-11,14-15H,3-6,12-13,16-17H2,1-2H3,(H,27,28)