N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(3-pyridin-3-ylpropylamino)piperidin-1-yl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(3-pyridin-3-ylpropylamino)piperidin-1-yl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-[3-(3-pyridyl)propylamino]-1-piperidyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-[3-(3-pyridinyl)propylamino]-1-piperidinyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(3-pyridin-3-ylpropylamino)piperidin-1-yl]benzamide Traditional Name: N-piperonyl-4-[4-[3-(3-pyridyl)propylamino]piperidino]benzamide Formula: C28H32N4O3 MolecularWeight: 472.57868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCCC2=CN=CC=C2)C3=CC=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1NCCCC2=CN=CC=C2)C3=CC=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H32N4O3/c33-28(31-19-22-5-10-26-27(17-22)35-20-34-26)23-6-8-25(9-7-23)32-15-11-24(12-16-32)30-14-2-4-21-3-1-13-29-18-21/h1,3,5-10,13,17-18,24,30H,2,4,11-12,14-16,19-20H2,(H,31,33)