[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]-(4-pyridyl)methanone CAS Name: [4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-pyridin-4-ylmethanone IUPAC Name: [4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-(2-chloro-4-nitro-phenyl)piperazino]-(4-pyridyl)methanone Formula: C16H15ClN4O3 MolecularWeight: 346.7683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C16H15ClN4O3/c17-14-11-13(21(23)24)1-2-15(14)19-7-9-20(10-8-19)16(22)12-3-5-18-6-4-12/h1-6,11H,7-10H2