ethyl 7-[4-(3-imidazol-1-ylpropoxy)phenoxy]-2,2-dimethyl-heptanoate

Systemtic Name: ethyl 7-[4-(3-imidazol-1-ylpropoxy)phenoxy]-2,2-dimethyl-heptanoate Openeye Name: ethyl 7-[4-(3-imidazol-1-ylpropoxy)phenoxy]-2,2-dimethyl-heptanoate CAS Name: 7-[4-[3-(1-imidazolyl)propoxy]phenoxy]-2,2-dimethylheptanoic acid ethyl ester IUPAC Name: ethyl 7-[4-(3-imidazol-1-ylpropoxy)phenoxy]-2,2-dimethylheptanoate Traditional Name: 7-[4-(3-imidazol-1-ylpropoxy)phenoxy]-2,2-dimethyl-enanthic acid ethyl ester Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCCCOC1=CC=C(C=C1)OCCCN2C=CN=C2

Isomeric SMILES

CCOC(=O)C(C)(C)CCCCCOC1=CC=C(C=C1)OCCCN2C=CN=C2

InChI

InChI=1S/C23H34N2O4/c1-4-27-22(26)23(2,3)13-6-5-7-17-28-20-9-11-21(12-10-20)29-18-8-15-25-16-14-24-19-25/h9-12,14,16,19H,4-8,13,15,17-18H2,1-3H3