5-(1-cyano-3-naphthalen-1-yl-butyl)-1H-imidazole-4-carboxylate

Systemtic Name: 5-(1-cyano-3-naphthalen-1-yl-butyl)-1H-imidazole-4-carboxylate Openeye Name: 5-[1-cyano-3-(1-naphthyl)butyl]-1H-imidazole-4-carboxylate CAS Name: 5-[1-cyano-3-(1-naphthalenyl)butyl]-1H-imidazole-4-carboxylate IUPAC Name: 5-(1-cyano-3-naphthalen-1-ylbutyl)-1H-imidazole-4-carboxylate Traditional Name: 5-[1-cyano-3-(1-naphthyl)butyl]-1H-imidazole-4-carboxylate Formula: C19H16N3O2- MolecularWeight: 318.34924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C#N)C1=C(N=CN1)C(=O)[O-])C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(CC(C#N)C1=C(N=CN1)C(=O)[O-])C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C19H17N3O2/c1-12(15-8-4-6-13-5-2-3-7-16(13)15)9-14(10-20)17-18(19(23)24)22-11-21-17/h2-8,11-12,14H,9H2,1H3,(H,21,22)(H,23,24)/p-1