2-(4-chlorophenyl)-N-[2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]pyridine-3-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-[2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]pyridine-3-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]pyridine-3-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[2-(1-pyrrolidinylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-3-pyridinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]pyridine-3-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[2-(pyrrolidinomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]nicotinamide Formula: C25H24ClN3O3 MolecularWeight: 449.92936

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2COC3=C(O2)C=CC(=C3)NC(=O)C4=C(N=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(C1)CC2COC3=C(O2)C=CC(=C3)NC(=O)C4=C(N=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H24ClN3O3/c26-18-7-5-17(6-8-18)24-21(4-3-11-27-24)25(30)28-19-9-10-22-23(14-19)31-16-20(32-22)15-29-12-1-2-13-29/h3-11,14,20H,1-2,12-13,15-16H2,(H,28,30)