methyl 6-[(3-oxidanylidene-2-pyridazin-3-yl-4-oxa-2-azaspiro[4.5]decan-8-yl)methylamino]pyridine-3-carboxylate

Systemtic Name: methyl 6-[(3-oxidanylidene-2-pyridazin-3-yl-4-oxa-2-azaspiro[4.5]decan-8-yl)methylamino]pyridine-3-carboxylate Openeye Name: methyl 6-[(3-oxo-2-pyridazin-3-yl-4-oxa-2-azaspiro[4.5]decan-8-yl)methylamino]pyridine-3-carboxylate CAS Name: 6-[[3-oxo-2-(3-pyridazinyl)-4-oxa-2-azaspiro[4.5]decan-8-yl]methylamino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(3-oxo-2-pyridazin-3-yl-4-oxa-2-azaspiro[4.5]decan-8-yl)methylamino]pyridine-3-carboxylate Traditional Name: 6-[(3-keto-2-pyridazin-3-yl-4-oxa-2-azaspiro[4.5]decan-8-yl)methylamino]nicotinic acid methyl ester Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)NCC2CCC3(CC2)CN(C(=O)O3)C4=NN=CC=C4

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)NCC2CCC3(CC2)CN(C(=O)O3)C4=NN=CC=C4

InChI

InChI=1S/C20H23N5O4/c1-28-18(26)15-4-5-16(22-12-15)21-11-14-6-8-20(9-7-14)13-25(19(27)29-20)17-3-2-10-23-24-17/h2-5,10,12,14H,6-9,11,13H2,1H3,(H,21,22)