methyl 7-(4-imidazol-1-ylphenyl)-7-oxidanyl-heptanoate

Systemtic Name: methyl 7-(4-imidazol-1-ylphenyl)-7-oxidanyl-heptanoate Openeye Name: methyl 7-hydroxy-7-(4-imidazol-1-ylphenyl)heptanoate CAS Name: 7-hydroxy-7-[4-(1-imidazolyl)phenyl]heptanoic acid methyl ester IUPAC Name: methyl 7-hydroxy-7-(4-imidazol-1-ylphenyl)heptanoate Traditional Name: 7-hydroxy-7-(4-imidazol-1-ylphenyl)enanthic acid methyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCC(C1=CC=C(C=C1)N2C=CN=C2)O

Isomeric SMILES

COC(=O)CCCCCC(C1=CC=C(C=C1)N2C=CN=C2)O

InChI

InChI=1S/C17H22N2O3/c1-22-17(21)6-4-2-3-5-16(20)14-7-9-15(10-8-14)19-12-11-18-13-19/h7-13,16,20H,2-6H2,1H3