1-(azepan-1-yl)-3-[2-[(4-chloranylphenoxy)methyl]benzimidazol-1-yl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[2-[(4-chloranylphenoxy)methyl]benzimidazol-1-yl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[2-[(4-chlorophenoxy)methyl]-1-benzimidazolyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]propan-1-one Formula: C23H26ClN3O2 MolecularWeight: 411.92444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2COC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H26ClN3O2/c24-18-9-11-19(12-10-18)29-17-22-25-20-7-3-4-8-21(20)27(22)16-13-23(28)26-14-5-1-2-6-15-26/h3-4,7-12H,1-2,5-6,13-17H2