ethyl 6-[4-[5-(benzimidazol-1-yl)pentoxy]phenoxy]-2,2-dimethyl-hexanoate

Systemtic Name: ethyl 6-[4-[5-(benzimidazol-1-yl)pentoxy]phenoxy]-2,2-dimethyl-hexanoate Openeye Name: ethyl 6-[4-[5-(benzimidazol-1-yl)pentoxy]phenoxy]-2,2-dimethyl-hexanoate CAS Name: 6-[4-[5-(1-benzimidazolyl)pentoxy]phenoxy]-2,2-dimethylhexanoic acid ethyl ester IUPAC Name: ethyl 6-[4-[5-(benzimidazol-1-yl)pentoxy]phenoxy]-2,2-dimethylhexanoate Traditional Name: 6-[4-[5-(benzimidazol-1-yl)pentoxy]phenoxy]-2,2-dimethyl-hexanoic acid ethyl ester Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCCOC1=CC=C(C=C1)OCCCCCN2C=NC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C(C)(C)CCCCOC1=CC=C(C=C1)OCCCCCN2C=NC3=CC=CC=C32

InChI

InChI=1S/C28H38N2O4/c1-4-32-27(31)28(2,3)18-8-11-21-34-24-16-14-23(15-17-24)33-20-10-5-9-19-30-22-29-25-12-6-7-13-26(25)30/h6-7,12-17,22H,4-5,8-11,18-21H2,1-3H3