methyl 3-[6-[2-(dimethylamino)-1-imidazol-1-yl-butyl]naphthalen-2-yl]oxy-2,2-dimethyl-propanoate

Systemtic Name: methyl 3-[6-[2-(dimethylamino)-1-imidazol-1-yl-butyl]naphthalen-2-yl]oxy-2,2-dimethyl-propanoate Openeye Name: methyl 3-[[6-[2-(dimethylamino)-1-imidazol-1-yl-butyl]-2-naphthyl]oxy]-2,2-dimethyl-propanoate CAS Name: 3-[[6-[2-(dimethylamino)-1-(1-imidazolyl)butyl]-2-naphthalenyl]oxy]-2,2-dimethylpropanoic acid methyl ester IUPAC Name: methyl 3-[6-[2-(dimethylamino)-1-imidazol-1-ylbutyl]naphthalen-2-yl]oxy-2,2-dimethylpropanoate Traditional Name: 3-[6-[2-(dimethylamino)-1-imidazol-1-yl-butyl]-2-naphthoxy]-2,2-dimethyl-propionic acid methyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3/c1-7-22(27(4)5)23(28-13-12-26-17-28)20-9-8-19-15-21(11-10-18(19)14-20)31-16-25(2,3)24(29)30-6/h8-15,17,22-23H,7,16H2,1-6H3