4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-butan-1-one

Systemtic Name: 4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-butan-1-one Openeye Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-butan-1-one CAS Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-1-benzimidazolyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-1-butanone IUPAC Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methylbenzimidazol-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylbutan-1-one Traditional Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-butan-1-one Formula: C29H30ClN3O2 MolecularWeight: 488.0204

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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)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCC(C)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H30ClN3O2/c1-20-6-5-9-26-28(20)31-27(19-35-25-12-10-24(30)11-13-25)33(26)17-14-21(2)29(34)32-16-15-22-7-3-4-8-23(22)18-32/h3-13,21H,14-19H2,1-2H3