N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-(3-methylphenyl)piperazine-1-carboxamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-(3-methylphenyl)piperazine-1-carboxamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-(m-tolyl)piperazine-1-carboxamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-(3-methylphenyl)-1-piperazinecarboxamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-(3-methylphenyl)piperazine-1-carboxamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-(m-tolyl)piperazine-1-carboxamide Formula: C19H19F2N3O3 MolecularWeight: 375.369266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

InChI

InChI=1S/C19H19F2N3O3/c1-13-3-2-4-15(11-13)23-7-9-24(10-8-23)18(25)22-14-5-6-16-17(12-14)27-19(20,21)26-16/h2-6,11-12H,7-10H2,1H3,(H,22,25)