methyl 2-[4-[[2-butyl-4-chloranyl-5-(phenylmethoxymethyl)imidazol-1-yl]methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[[2-butyl-4-chloranyl-5-(phenylmethoxymethyl)imidazol-1-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[5-(benzyloxymethyl)-2-butyl-4-chloro-imidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-butyl-4-chloro-5-(phenylmethoxymethyl)-1-imidazolyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-butyl-4-chloro-5-(phenylmethoxymethyl)imidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[5-(benzoxymethyl)-2-butyl-4-chloro-imidazol-1-yl]methyl]phenyl]benzoic acid methyl ester Formula: C30H31ClN2O3 MolecularWeight: 503.03174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC)COCC4=CC=CC=C4)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC)COCC4=CC=CC=C4)Cl

InChI

InChI=1S/C30H31ClN2O3/c1-3-4-14-28-32-29(31)27(21-36-20-23-10-6-5-7-11-23)33(28)19-22-15-17-24(18-16-22)25-12-8-9-13-26(25)30(34)35-2/h5-13,15-18H,3-4,14,19-21H2,1-2H3