1-[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]naphthalen-2-yl]oxycyclopropane-1-carboxylic acid

Systemtic Name: 1-[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]naphthalen-2-yl]oxycyclopropane-1-carboxylic acid Openeye Name: 1-[[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]-2-naphthyl]oxy]cyclopropanecarboxylic acid CAS Name: 1-[[6-[2-(dimethylamino)-1-(1-imidazolyl)propyl]-2-naphthalenyl]oxy]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[6-[2-(dimethylamino)-1-imidazol-1-ylpropyl]naphthalen-2-yl]oxycyclopropane-1-carboxylic acid Traditional Name: 1-[6-[2-(dimethylamino)-1-imidazol-1-yl-propyl]-2-naphthoxy]cyclopropanecarboxylic acid Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(C=C1)C=C(C=C2)OC3(CC3)C(=O)O)N4C=CN=C4)N(C)C

Isomeric SMILES

CC(C(C1=CC2=C(C=C1)C=C(C=C2)OC3(CC3)C(=O)O)N4C=CN=C4)N(C)C

InChI

InChI=1S/C22H25N3O3/c1-15(24(2)3)20(25-11-10-23-14-25)18-5-4-17-13-19(7-6-16(17)12-18)28-22(8-9-22)21(26)27/h4-7,10-15,20H,8-9H2,1-3H3,(H,26,27)