[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(2-pyridyl)-4-quinolyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(2-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Traditional Name: (4-piperonylpiperazino)-[2-(2-pyridyl)-4-quinolyl]methanone Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=N6

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=N6

InChI

InChI=1S/C27H24N4O3/c32-27(21-16-24(23-7-3-4-10-28-23)29-22-6-2-1-5-20(21)22)31-13-11-30(12-14-31)17-19-8-9-25-26(15-19)34-18-33-25/h1-10,15-16H,11-14,17-18H2