2-(7,8-dihydronaphthalen-1-yloxy)-4-[4-(diphenylmethyl)-2-oxidanylidene-imidazol-1-ium-1-yl]butanoic acid

Systemtic Name: 2-(7,8-dihydronaphthalen-1-yloxy)-4-[4-(diphenylmethyl)-2-oxidanylidene-imidazol-1-ium-1-yl]butanoic acid Openeye Name: 4-(4-benzhydryl-2-oxo-imidazol-1-ium-1-yl)-2-(7,8-dihydronaphthalen-1-yloxy)butanoic acid CAS Name: 2-(7,8-dihydronaphthalen-1-yloxy)-4-[4-(diphenylmethyl)-2-oxo-1-imidazol-1-iumyl]butanoic acid IUPAC Name: 4-(4-benzhydryl-2-oxoimidazol-1-ium-1-yl)-2-(7,8-dihydronaphthalen-1-yloxy)butanoic acid Traditional Name: 4-(4-benzhydryl-2-keto-imidazol-1-ium-1-yl)-2-(7,8-dihydronaphthalen-1-yloxy)butyric acid Formula: C30H27N2O4+ MolecularWeight: 479.54638

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1)C=CC=C2OC(CC[N+]3=CC(=NC3=O)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CC2=C(C=C1)C=CC=C2OC(CC[N+]3=CC(=NC3=O)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C30H26N2O4/c33-29(34)27(36-26-17-9-15-21-10-7-8-16-24(21)26)18-19-32-20-25(31-30(32)35)28(22-11-3-1-4-12-22)23-13-5-2-6-14-23/h1-7,9-15,17,20,27-28H,8,16,18-19H2/p+1