2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-2,3-dihydro-1,4-benzoxazine CAS Name: 2-[[4-(3-chlorophenyl)-1-piperazinyl]methyl]-4-phenyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 2-[[4-(3-chlorophenyl)piperazino]methyl]-4-phenyl-2,3-dihydro-1,4-benzoxazine Formula: C25H26ClN3O MolecularWeight: 419.94644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2CN(C3=CC=CC=C3O2)C4=CC=CC=C4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2CN(C3=CC=CC=C3O2)C4=CC=CC=C4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H26ClN3O/c26-20-7-6-10-22(17-20)28-15-13-27(14-16-28)18-23-19-29(21-8-2-1-3-9-21)24-11-4-5-12-25(24)30-23/h1-12,17,23H,13-16,18-19H2