N-[6-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]pyridin-3-yl]-2-chloranyl-benzamide

Systemtic Name: N-[6-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]pyridin-3-yl]-2-chloranyl-benzamide Openeye Name: N-[6-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-3-pyridyl]-2-chloro-benzamide CAS Name: N-[6-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-3-pyridinyl]-2-chlorobenzamide IUPAC Name: N-[6-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]pyridin-3-yl]-2-chlorobenzamide Traditional Name: 2-chloro-N-[6-(4-piperonyloylpiperazino)-3-pyridyl]benzamide Formula: C24H21ClN4O4 MolecularWeight: 464.90094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H21ClN4O4/c25-19-4-2-1-3-18(19)23(30)27-17-6-8-22(26-14-17)28-9-11-29(12-10-28)24(31)16-5-7-20-21(13-16)33-15-32-20/h1-8,13-14H,9-12,15H2,(H,27,30)