[4-(4-nitrophenyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone

Systemtic Name: [4-(4-nitrophenyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Openeye Name: [4-(4-nitrophenyl)piperazin-1-yl]-[2-(2-pyridyl)-4-quinolyl]methanone CAS Name: [4-(4-nitrophenyl)-1-piperazinyl]-[2-(2-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-(4-nitrophenyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Traditional Name: [4-(4-nitrophenyl)piperazino]-[2-(2-pyridyl)-4-quinolyl]methanone Formula: C25H21N5O3 MolecularWeight: 439.46594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C25H21N5O3/c31-25(29-15-13-28(14-16-29)18-8-10-19(11-9-18)30(32)33)21-17-24(23-7-3-4-12-26-23)27-22-6-2-1-5-20(21)22/h1-12,17H,13-16H2