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

Systemtic Name: 8-butyl-7-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-5-methyl-1,6-dihydropyrrolo[3,2-c]azepin-4-one Openeye Name: 8-butyl-7-[4-(4-fluorobenzoyl)-1-piperidyl]-5-methyl-1,6-dihydropyrrolo[3,2-c]azepin-4-one CAS Name: 8-butyl-7-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-5-methyl-1,6-dihydropyrrolo[3,2-c]azepin-4-one IUPAC Name: 8-butyl-7-[4-(4-fluorobenzoyl)piperidin-1-yl]-5-methyl-1,6-dihydropyrrolo[3,2-c]azepin-4-one Traditional Name: 8-butyl-7-[4-(4-fluorobenzoyl)piperidino]-5-methyl-1,6-dihydropyrrol[3,2-c]azepin-4-one Formula: C25H30FN3O2 MolecularWeight: 423.523003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(CN(C(=O)C2=C1NC=C2)C)N3CCC(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCCCC1=C(CN(C(=O)C2=C1NC=C2)C)N3CCC(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H30FN3O2/c1-3-4-5-20-22(16-28(2)25(31)21-10-13-27-23(20)21)29-14-11-18(12-15-29)24(30)17-6-8-19(26)9-7-17/h6-10,13,18,27H,3-5,11-12,14-16H2,1-2H3