4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-1-(3-phenylpiperidin-1-yl)butan-1-one

Systemtic Name: 4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-1-(3-phenylpiperidin-1-yl)butan-1-one Openeye Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-1-(3-phenyl-1-piperidyl)butan-1-one CAS Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-1-benzimidazolyl]-2-methyl-1-(3-phenyl-1-piperidinyl)-1-butanone IUPAC Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methylbenzimidazol-1-yl]-2-methyl-1-(3-phenylpiperidin-1-yl)butan-1-one Traditional Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-1-(3-phenylpiperidino)butan-1-one Formula: C31H34ClN3O2 MolecularWeight: 516.07356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCC(C)C(=O)N4CCCC(C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCC(C)C(=O)N4CCCC(C4)C5=CC=CC=C5

InChI

InChI=1S/C31H34ClN3O2/c1-22-8-6-12-28-30(22)33-29(21-37-27-15-13-26(32)14-16-27)35(28)19-17-23(2)31(36)34-18-7-11-25(20-34)24-9-4-3-5-10-24/h3-6,8-10,12-16,23,25H,7,11,17-21H2,1-2H3