N-(2-methoxy-5-nitro-phenyl)-1-(6-phenylpyridazin-3-yl)piperidine-4-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-1-(6-phenylpyridazin-3-yl)piperidine-4-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-1-(6-phenylpyridazin-3-yl)piperidine-4-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-1-(6-phenyl-3-pyridazinyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-1-(6-phenylpyridazin-3-yl)piperidine-4-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-1-(6-phenylpyridazin-3-yl)isonipecotamide Formula: C23H23N5O4 MolecularWeight: 433.45982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O4/c1-32-21-9-7-18(28(30)31)15-20(21)24-23(29)17-11-13-27(14-12-17)22-10-8-19(25-26-22)16-5-3-2-4-6-16/h2-10,15,17H,11-14H2,1H3,(H,24,29)