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

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]pyridine-3-carboxamide Openeye Name: N-[2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]pyridine-3-carboxamide CAS Name: N-[2-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]pyridine-3-carboxamide Traditional Name: N-[5-(piperazine-1-carbonyl)-2-(4-piperonyloylpiperazino)phenyl]nicotinamide Formula: C29H30N6O5 MolecularWeight: 542.5857

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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=CN=CC=C6

Isomeric SMILES

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

InChI

InChI=1S/C29H30N6O5/c36-27(22-2-1-7-31-18-22)32-23-16-20(28(37)34-10-8-30-9-11-34)3-5-24(23)33-12-14-35(15-13-33)29(38)21-4-6-25-26(17-21)40-19-39-25/h1-7,16-18,30H,8-15,19H2,(H,32,36)