N-[2-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3-fluoro-benzamide CAS Name: N-[2-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]-3-fluorobenzamide IUPAC Name: N-[2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3-fluorobenzamide Traditional Name: 3-fluoro-N-[5-(piperazine-1-carbonyl)-2-(4-piperonyloylpiperazino)phenyl]benzamide Formula: C30H30FN5O5 MolecularWeight: 559.588103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5)NC(=O)C6=CC(=CC=C6)F

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5)NC(=O)C6=CC(=CC=C6)F

InChI

InChI=1S/C30H30FN5O5/c31-23-3-1-2-20(16-23)28(37)33-24-17-21(29(38)35-10-8-32-9-11-35)4-6-25(24)34-12-14-36(15-13-34)30(39)22-5-7-26-27(18-22)41-19-40-26/h1-7,16-18,32H,8-15,19H2,(H,33,37)