ethyl 2-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]naphthalen-2-yl]oxymethyl]-2-ethyl-butanoate

Systemtic Name: ethyl 2-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]naphthalen-2-yl]oxymethyl]-2-ethyl-butanoate Openeye Name: ethyl 2-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]-2-naphthyl]oxymethyl]-2-ethyl-butanoate CAS Name: 2-[[6-[2-(dimethylamino)-1-(1-imidazolyl)propyl]-2-naphthalenyl]oxymethyl]-2-ethylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[[6-[2-(dimethylamino)-1-imidazol-1-ylpropyl]naphthalen-2-yl]oxymethyl]-2-ethylbutanoate Traditional Name: 2-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]-2-naphthoxy]methyl]-2-ethyl-butyric acid ethyl ester Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(COC1=CC2=C(C=C1)C=C(C=C2)C(C(C)N(C)C)N3C=CN=C3)C(=O)OCC

Isomeric SMILES

CCC(CC)(COC1=CC2=C(C=C1)C=C(C=C2)C(C(C)N(C)C)N3C=CN=C3)C(=O)OCC

InChI

InChI=1S/C27H37N3O3/c1-7-27(8-2,26(31)32-9-3)18-33-24-13-12-21-16-23(11-10-22(21)17-24)25(20(4)29(5)6)30-15-14-28-19-30/h10-17,19-20,25H,7-9,18H2,1-6H3