N-heptan-2-yl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-heptan-2-yl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-(1-methylhexyl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-heptan-2-yl-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-heptan-2-yl-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: 6-keto-N-(1-methylhexyl)-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=NN(C(=O)C=C1)CCOC2=CC=CC=C2

Isomeric SMILES

CCCCCC(C)NC(=O)C1=NN(C(=O)C=C1)CCOC2=CC=CC=C2

InChI

InChI=1S/C20H27N3O3/c1-3-4-6-9-16(2)21-20(25)18-12-13-19(24)23(22-18)14-15-26-17-10-7-5-8-11-17/h5,7-8,10-13,16H,3-4,6,9,14-15H2,1-2H3,(H,21,25)