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

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-naphthalen-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2-naphthyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-(2-naphthalenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-naphthalen-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2-naphthyl)methyl]-1,4-diazepane Formula: C24H27ClN2O MolecularWeight: 394.93698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=CC3=CC=CC=C3C=C2)N4CCCNCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=CC3=CC=CC=C3C=C2)N4CCCNCC4

InChI

InChI=1S/C24H27ClN2O/c1-2-28-23-11-10-21(25)17-22(23)24(27-14-5-12-26-13-15-27)20-9-8-18-6-3-4-7-19(18)16-20/h3-4,6-11,16-17,24,26H,2,5,12-15H2,1H3