1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-5-[(3-oxidanylpiperidin-1-yl)methyl]cinnoline-3-carboxamide

Systemtic Name: 1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-5-[(3-oxidanylpiperidin-1-yl)methyl]cinnoline-3-carboxamide Openeye Name: 5-[(3-hydroxy-1-piperidyl)methyl]-1-methyl-6-(morpholinomethyl)-4-oxo-cinnoline-3-carboxamide CAS Name: 5-[(3-hydroxy-1-piperidinyl)methyl]-1-methyl-6-(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: 5-[(3-hydroxypiperidin-1-yl)methyl]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: 5-[(3-hydroxypiperidino)methyl]-4-keto-1-methyl-6-(morpholinomethyl)cinnoline-3-carboxamide Formula: C21H29N5O4 MolecularWeight: 415.48606

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=C(C=C2)CN3CCOCC3)CN4CCCC(C4)O)C(=O)C(=N1)C(=O)N

Isomeric SMILES

CN1C2=C(C(=C(C=C2)CN3CCOCC3)CN4CCCC(C4)O)C(=O)C(=N1)C(=O)N

InChI

InChI=1S/C21H29N5O4/c1-24-17-5-4-14(11-25-7-9-30-10-8-25)16(13-26-6-2-3-15(27)12-26)18(17)20(28)19(23-24)21(22)29/h4-5,15,27H,2-3,6-13H2,1H3,(H2,22,29)