1-[[2,4-bis(fluoranyl)phenyl]methyl]-5-(4-propan-2-ylpiperazin-1-yl)azepan-2-one

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]methyl]-5-(4-propan-2-ylpiperazin-1-yl)azepan-2-one Openeye Name: 1-[(2,4-difluorophenyl)methyl]-5-(4-isopropylpiperazin-1-yl)azepan-2-one CAS Name: 1-[(2,4-difluorophenyl)methyl]-5-(4-propan-2-yl-1-piperazinyl)-2-azepanone IUPAC Name: 1-[(2,4-difluorophenyl)methyl]-5-(4-propan-2-ylpiperazin-1-yl)azepan-2-one Traditional Name: 1-(2,4-difluorobenzyl)-5-(4-isopropylpiperazino)azepan-2-one Formula: C20H29F2N3O MolecularWeight: 365.460566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2CCC(=O)N(CC2)CC3=C(C=C(C=C3)F)F

Isomeric SMILES

CC(C)N1CCN(CC1)C2CCC(=O)N(CC2)CC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C20H29F2N3O/c1-15(2)23-9-11-24(12-10-23)18-5-6-20(26)25(8-7-18)14-16-3-4-17(21)13-19(16)22/h3-4,13,15,18H,5-12,14H2,1-2H3