methyl 2-[4-[(6-azanyl-4-chloranyl-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[(6-azanyl-4-chloranyl-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[(6-amino-4-chloro-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoate CAS Name: 2-[4-[(6-amino-4-chloro-2-propyl-1-benzimidazolyl)methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(6-amino-4-chloro-2-propylbenzimidazol-1-yl)methyl]phenyl]benzoate Traditional Name: 2-[4-[(6-amino-4-chloro-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoic acid methyl ester Formula: C25H24ClN3O2 MolecularWeight: 433.92996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)N)Cl

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)N)Cl

InChI

InChI=1S/C25H24ClN3O2/c1-3-6-23-28-24-21(26)13-18(27)14-22(24)29(23)15-16-9-11-17(12-10-16)19-7-4-5-8-20(19)25(30)31-2/h4-5,7-14H,3,6,15,27H2,1-2H3