1-[[4-[(3,4-dichlorophenyl)methyl]-1,4-oxazepan-6-yl]methyl]-3-phenethyl-urea

Systemtic Name: 1-[[4-[(3,4-dichlorophenyl)methyl]-1,4-oxazepan-6-yl]methyl]-3-phenethyl-urea Openeye Name: 1-[[4-[(3,4-dichlorophenyl)methyl]-1,4-oxazepan-6-yl]methyl]-3-phenethyl-urea CAS Name: 1-[[4-[(3,4-dichlorophenyl)methyl]-1,4-oxazepan-6-yl]methyl]-3-phenethylurea IUPAC Name: 1-[[4-[(3,4-dichlorophenyl)methyl]-1,4-oxazepan-6-yl]methyl]-3-phenethylurea Traditional Name: 1-[[4-(3,4-dichlorobenzyl)-1,4-oxazepan-6-yl]methyl]-3-phenethyl-urea Formula: C22H27Cl2N3O2 MolecularWeight: 436.37468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC(CN1CC2=CC(=C(C=C2)Cl)Cl)CNC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1COCC(CN1CC2=CC(=C(C=C2)Cl)Cl)CNC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H27Cl2N3O2/c23-20-7-6-18(12-21(20)24)14-27-10-11-29-16-19(15-27)13-26-22(28)25-9-8-17-4-2-1-3-5-17/h1-7,12,19H,8-11,13-16H2,(H2,25,26,28)