1-[4-[3-(3-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[4-[3-(3-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanoyl]piperidine-4-carboxamide Openeye Name: 1-[4-[3-(3-methoxyphenyl)-6-oxo-pyridazin-1-yl]butanoyl]piperidine-4-carboxamide CAS Name: 1-[4-[3-(3-methoxyphenyl)-6-oxo-1-pyridazinyl]-1-oxobutyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-[3-(3-methoxyphenyl)-6-oxopyridazin-1-yl]butanoyl]piperidine-4-carboxamide Traditional Name: 1-[4-[6-keto-3-(3-methoxyphenyl)pyridazin-1-yl]butanoyl]isonipecotamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H26N4O4/c1-29-17-5-2-4-16(14-17)18-7-8-20(27)25(23-18)11-3-6-19(26)24-12-9-15(10-13-24)21(22)28/h2,4-5,7-8,14-15H,3,6,9-13H2,1H3,(H2,22,28)