2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(3-chloro-4-fluoro-anilino)propan-1-one CAS Name: 2-(3-chloro-4-fluoroanilino)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(3-chloro-4-fluoroanilino)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-2-(3-chloro-4-fluoro-anilino)propan-1-one Formula: C20H23ClFN3O MolecularWeight: 375.867523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H23ClFN3O/c1-15(23-17-7-8-19(22)18(21)13-17)20(26)25-11-9-24(10-12-25)14-16-5-3-2-4-6-16/h2-8,13,15,23H,9-12,14H2,1H3