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

Systemtic Name: ethyl 1-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]naphthalen-2-yl]oxymethyl]cyclobutane-1-carboxylate Openeye Name: ethyl 1-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]-2-naphthyl]oxymethyl]cyclobutanecarboxylate CAS Name: 1-[[6-[2-(dimethylamino)-1-(1-imidazolyl)propyl]-2-naphthalenyl]oxymethyl]-1-cyclobutanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[6-[2-(dimethylamino)-1-imidazol-1-ylpropyl]naphthalen-2-yl]oxymethyl]cyclobutane-1-carboxylate Traditional Name: 1-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]-2-naphthoxy]methyl]cyclobutanecarboxylic acid ethyl ester Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC1)COC2=CC3=C(C=C2)C=C(C=C3)C(C(C)N(C)C)N4C=CN=C4

Isomeric SMILES

CCOC(=O)C1(CCC1)COC2=CC3=C(C=C2)C=C(C=C3)C(C(C)N(C)C)N4C=CN=C4

InChI

InChI=1S/C26H33N3O3/c1-5-31-25(30)26(11-6-12-26)17-32-23-10-9-20-15-22(8-7-21(20)16-23)24(19(2)28(3)4)29-14-13-27-18-29/h7-10,13-16,18-19,24H,5-6,11-12,17H2,1-4H3