[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]-phenyl-methanone; methanamine

Systemtic Name: [4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]-phenyl-methanone; methanamine Openeye Name: [4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]-phenyl-methanone; methanamine CAS Name: [4-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxyphenyl]-phenylmethanone; methanamine IUPAC Name: [4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxyphenyl]-phenylmethanone; methanamine Traditional Name: [4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]-phenyl-methanone; methylamine Formula: C27H28ClN3O2 MolecularWeight: 461.98312

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Descriptors Computed from Structure

Canonical SMILES:

CN.C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4

Isomeric SMILES

CN.C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4

InChI

InChI=1S/C26H23ClN2O2.CH5N/c27-23-11-6-20(7-12-23)8-13-25(18-29-17-16-28-19-29)31-24-14-9-22(10-15-24)26(30)21-4-2-1-3-5-21;1-2/h1-7,9-12,14-17,19,25H,8,13,18H2;2H2,1H3