4-[bis[4-(4-fluorophenyl)butyl]amino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one hydrobromide

Systemtic Name: 4-[bis[4-(4-fluorophenyl)butyl]amino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one hydrobromide Openeye Name: 4-[bis[4-(4-fluorophenyl)butyl]amino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one hydrobromide CAS Name: 4-[bis[4-(4-fluorophenyl)butyl]amino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one hydrobromide IUPAC Name: 4-[bis[4-(4-fluorophenyl)butyl]amino]-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one hydrobromide Traditional Name: 4-[bis[4-(4-fluorophenyl)butyl]amino]-4,5,6,7-tetrahydroindoxazen-3-one hydrobromide Formula: C27H33BrF2N2O2 MolecularWeight: 535.463926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)ONC2=O)N(CCCCC3=CC=C(C=C3)F)CCCCC4=CC=C(C=C4)F.Br

Isomeric SMILES

C1CC(C2=C(C1)ONC2=O)N(CCCCC3=CC=C(C=C3)F)CCCCC4=CC=C(C=C4)F.Br

InChI

InChI=1S/C27H32F2N2O2.BrH/c28-22-14-10-20(11-15-22)6-1-3-18-31(19-4-2-7-21-12-16-23(29)17-13-21)24-8-5-9-25-26(24)27(32)30-33-25;/h10-17,24H,1-9,18-19H2,(H,30,32);1H