7-[4-(4-fluorophenyl)piperazin-1-yl]-8-oxidanyl-1-phenyl-5-propyl-7,8-dihydro-6H-pyrrolo[3,2-c]azepin-4-one

Systemtic Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-8-oxidanyl-1-phenyl-5-propyl-7,8-dihydro-6H-pyrrolo[3,2-c]azepin-4-one Openeye Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-8-hydroxy-1-phenyl-5-propyl-7,8-dihydro-6H-pyrrolo[3,2-c]azepin-4-one CAS Name: 7-[4-(4-fluorophenyl)-1-piperazinyl]-8-hydroxy-1-phenyl-5-propyl-7,8-dihydro-6H-pyrrolo[3,2-c]azepin-4-one IUPAC Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-8-hydroxy-1-phenyl-5-propyl-7,8-dihydro-6H-pyrrolo[3,2-c]azepin-4-one Traditional Name: 7-[4-(4-fluorophenyl)piperazino]-8-hydroxy-1-phenyl-5-propyl-7,8-dihydro-6H-pyrrol[3,2-c]azepin-4-one Formula: C27H31FN4O2 MolecularWeight: 462.559043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC(C(C2=C(C1=O)C=CN2C3=CC=CC=C3)O)N4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

CCCN1CC(C(C2=C(C1=O)C=CN2C3=CC=CC=C3)O)N4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H31FN4O2/c1-2-13-31-19-24(30-17-15-29(16-18-30)21-10-8-20(28)9-11-21)26(33)25-23(27(31)34)12-14-32(25)22-6-4-3-5-7-22/h3-12,14,24,26,33H,2,13,15-19H2,1H3