2-[(4-chloranylphenoxy)methyl]-4-methyl-1-[3-(phenylmethyl)-4-piperidin-1-yl-butyl]benzimidazole

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-4-methyl-1-[3-(phenylmethyl)-4-piperidin-1-yl-butyl]benzimidazole Openeye Name: 1-[3-benzyl-4-(1-piperidyl)butyl]-2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazole CAS Name: 2-[(4-chlorophenoxy)methyl]-4-methyl-1-[3-(phenylmethyl)-4-(1-piperidinyl)butyl]benzimidazole IUPAC Name: 1-(3-benzyl-4-piperidin-1-ylbutyl)-2-[(4-chlorophenoxy)methyl]-4-methylbenzimidazole Traditional Name: 1-(3-benzyl-4-piperidino-butyl)-2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazole Formula: C31H36ClN3O MolecularWeight: 502.09004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCC(CC4=CC=CC=C4)CN5CCCCC5

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCC(CC4=CC=CC=C4)CN5CCCCC5

InChI

InChI=1S/C31H36ClN3O/c1-24-9-8-12-29-31(24)33-30(23-36-28-15-13-27(32)14-16-28)35(29)20-17-26(21-25-10-4-2-5-11-25)22-34-18-6-3-7-19-34/h2,4-5,8-16,26H,3,6-7,17-23H2,1H3