N-[2-[4-[(2R)-2-phenylcyclopropyl]carbonylpiperazin-1-yl]pyridin-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-[(2R)-2-phenylcyclopropyl]carbonylpiperazin-1-yl]pyridin-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-[(2R)-2-phenylcyclopropanecarbonyl]piperazin-1-yl]-3-pyridyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-[oxo-[(2R)-2-phenylcyclopropyl]methyl]-1-piperazinyl]-3-pyridinyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-[(2R)-2-phenylcyclopropanecarbonyl]piperazin-1-yl]pyridin-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-[(2R)-2-phenylcyclopropanecarbonyl]piperazino]-3-pyridyl]-piperonylamide Formula: C27H26N4O4 MolecularWeight: 470.51974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)C5CC5C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)C5C[C@H]5C6=CC=CC=C6

InChI

InChI=1S/C27H26N4O4/c32-26(19-8-9-23-24(15-19)35-17-34-23)29-22-7-4-10-28-25(22)30-11-13-31(14-12-30)27(33)21-16-20(21)18-5-2-1-3-6-18/h1-10,15,20-21H,11-14,16-17H2,(H,29,32)/t20-,21?/m0/s1