(6-chloranyl-2H-chromen-3-yl)-[4-(6-nitropyridin-3-yl)piperazin-1-yl]methanone

Systemtic Name: (6-chloranyl-2H-chromen-3-yl)-[4-(6-nitropyridin-3-yl)piperazin-1-yl]methanone Openeye Name: (6-chloro-2H-chromen-3-yl)-[4-(6-nitro-3-pyridyl)piperazin-1-yl]methanone CAS Name: (6-chloro-2H-1-benzopyran-3-yl)-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methanone IUPAC Name: (6-chloro-2H-chromen-3-yl)-[4-(6-nitropyridin-3-yl)piperazin-1-yl]methanone Traditional Name: (6-chloro-2H-chromen-3-yl)-[4-(6-nitro-3-pyridyl)piperazino]methanone Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C19H17ClN4O4/c20-15-1-3-17-13(10-15)9-14(12-28-17)19(25)23-7-5-22(6-8-23)16-2-4-18(21-11-16)24(26)27/h1-4,9-11H,5-8,12H2