5-(1,3-benzodioxol-5-yl)-2-methoxy-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyridine-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-2-methoxy-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyridine-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-2-methoxy-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyridine-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-2-methoxy-N-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-2-methoxy-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyridine-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-2-methoxy-N-[4-[(4-methylpiperazino)methyl]phenyl]nicotinamide Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=C(N=CC(=C3)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=C(N=CC(=C3)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C26H28N4O4/c1-29-9-11-30(12-10-29)16-18-3-6-21(7-4-18)28-25(31)22-13-20(15-27-26(22)32-2)19-5-8-23-24(14-19)34-17-33-23/h3-8,13-15H,9-12,16-17H2,1-2H3,(H,28,31)