2-[4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-[2-[(4-chlorophenoxy)methyl]-4-methyl-1-benzimidazolyl]-2-methylbutyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-[2-[(4-chlorophenoxy)methyl]-4-methylbenzimidazol-1-yl]-2-methylbutyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butyl]-3,4-dihydro-1H-isoquinoline Formula: C29H32ClN3O MolecularWeight: 474.03688

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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)CN4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCC(C)CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H32ClN3O/c1-21(18-32-16-15-23-7-3-4-8-24(23)19-32)14-17-33-27-9-5-6-22(2)29(27)31-28(33)20-34-26-12-10-25(30)11-13-26/h3-13,21H,14-20H2,1-2H3