1-[4-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]butyl]-7-methyl-4-oxidanyl-5,6-dihydro-4H-pyrrolo[2,3-c]azepin-8-one

Systemtic Name: 1-[4-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]butyl]-7-methyl-4-oxidanyl-5,6-dihydro-4H-pyrrolo[2,3-c]azepin-8-one Openeye Name: 1-[4-[4-(4-fluorobenzoyl)-1-piperidyl]butyl]-4-hydroxy-7-methyl-5,6-dihydro-4H-pyrrolo[2,3-c]azepin-8-one CAS Name: 1-[4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]butyl]-4-hydroxy-7-methyl-5,6-dihydro-4H-pyrrolo[2,3-c]azepin-8-one IUPAC Name: 1-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-4-hydroxy-7-methyl-5,6-dihydro-4H-pyrrolo[2,3-c]azepin-8-one Traditional Name: 1-[4-[4-(4-fluorobenzoyl)piperidino]butyl]-4-hydroxy-7-methyl-5,6-dihydro-4H-pyrrol[2,3-c]azepin-8-one Formula: C25H32FN3O3 MolecularWeight: 441.538283

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C2=C(C1=O)N(C=C2)CCCCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F)O

Isomeric SMILES

CN1CCC(C2=C(C1=O)N(C=C2)CCCCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F)O

InChI

InChI=1S/C25H32FN3O3/c1-27-14-11-22(30)21-10-17-29(23(21)25(27)32)13-3-2-12-28-15-8-19(9-16-28)24(31)18-4-6-20(26)7-5-18/h4-7,10,17,19,22,30H,2-3,8-9,11-16H2,1H3