1-[(5-chloranyl-2-ethoxy-phenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane Formula: C22H29ClN2O MolecularWeight: 372.93146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29ClN2O/c1-4-26-21-7-6-19(23)15-20(21)22(25-10-5-8-24-9-11-25)18-13-16(2)12-17(3)14-18/h6-7,12-15,22,24H,4-5,8-11H2,1-3H3