1-[4-(1-bromanylnaphthalen-2-yl)oxybutyl]imidazole; ethanedioic acid

Systemtic Name: 1-[4-(1-bromanylnaphthalen-2-yl)oxybutyl]imidazole; ethanedioic acid Openeye Name: 1-[4-[(1-bromo-2-naphthyl)oxy]butyl]imidazole; oxalic acid CAS Name: 1-[4-[(1-bromo-2-naphthalenyl)oxy]butyl]imidazole; oxalic acid IUPAC Name: 1-[4-(1-bromonaphthalen-2-yl)oxybutyl]imidazole; oxalic acid Traditional Name: 1-[4-(1-bromo-2-naphthoxy)butyl]imidazole; oxalic acid Formula: C19H19BrN2O5 MolecularWeight: 435.26856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2Br)OCCCCN3C=CN=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2Br)OCCCCN3C=CN=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H17BrN2O.C2H2O4/c18-17-15-6-2-1-5-14(15)7-8-16(17)21-12-4-3-10-20-11-9-19-13-20;3-1(4)2(5)6/h1-2,5-9,11,13H,3-4,10,12H2;(H,3,4)(H,5,6)