6-(4-methoxy-3-nitro-phenyl)-2-pent-2-ynyl-3,5-dihydropyridazin-4-one

Systemtic Name: 6-(4-methoxy-3-nitro-phenyl)-2-pent-2-ynyl-3,5-dihydropyridazin-4-one Openeye Name: 6-(4-methoxy-3-nitro-phenyl)-2-pent-2-ynyl-3,5-dihydropyridazin-4-one CAS Name: 6-(4-methoxy-3-nitrophenyl)-2-pent-2-ynyl-3,5-dihydropyridazin-4-one IUPAC Name: 6-(4-methoxy-3-nitrophenyl)-2-pent-2-ynyl-3,5-dihydropyridazin-4-one Traditional Name: 6-(4-methoxy-3-nitro-phenyl)-2-pent-2-ynyl-3,5-dihydropyridazin-4-one Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCN1CC(=O)CC(=N1)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCC#CCN1CC(=O)CC(=N1)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-3-4-5-8-18-11-13(20)10-14(17-18)12-6-7-16(23-2)15(9-12)19(21)22/h6-7,9H,3,8,10-11H2,1-2H3