methyl 1-[2-(3-methyl-6-oxidanylidene-pyridazin-1-yl)ethyl]-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(3-methyl-6-oxidanylidene-pyridazin-1-yl)ethyl]-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3-methyl-6-oxo-pyridazin-1-yl)ethyl]-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 1-[2-(3-methyl-6-oxo-1-pyridazinyl)ethyl]-4-[N-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-methyl-6-oxopyridazin-1-yl)ethyl]-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-[2-(6-keto-3-methyl-pyridazin-1-yl)ethyl]-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCN3C(=O)C=CC(=N3)C)C(=O)OC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCN3C(=O)C=CC(=N3)C)C(=O)OC

InChI

InChI=1S/C23H30N4O4/c1-4-20(28)27(19-8-6-5-7-9-19)23(22(30)31-3)12-14-25(15-13-23)16-17-26-21(29)11-10-18(2)24-26/h5-11H,4,12-17H2,1-3H3