1-[(5-chloranyl-2-ethoxy-phenyl)-(2,4-dichlorophenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-(2,4-dichlorophenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2,4-dichlorophenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-(2,4-dichlorophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-(2,4-dichlorophenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2,4-dichlorophenyl)methyl]-1,4-diazepane Formula: C20H23Cl3N2O MolecularWeight: 413.76842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=C(C=C(C=C2)Cl)Cl)N3CCCNCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=C(C=C(C=C2)Cl)Cl)N3CCCNCC3

InChI

InChI=1S/C20H23Cl3N2O/c1-2-26-19-7-5-14(21)12-17(19)20(25-10-3-8-24-9-11-25)16-6-4-15(22)13-18(16)23/h4-7,12-13,20,24H,2-3,8-11H2,1H3