(5E)-N-(1,3-benzodioxol-5-ylmethyl)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide

Systemtic Name: (5E)-N-(1,3-benzodioxol-5-ylmethyl)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide Openeye Name: (5E)-N-(1,3-benzodioxol-5-ylmethyl)-5-(5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide CAS Name: (5E)-N-(1,3-benzodioxol-5-ylmethyl)-5-(5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazole-3-carboxamide IUPAC Name: (5E)-N-(1,3-benzodioxol-5-ylmethyl)-5-(5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide Traditional Name: (5E)-5-(6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)-N-piperonyl-3-pyrazoline-3-carboxamide Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C2C=C(NN2)C(=O)NCC3=CC4=C(C=C3)OCO4)C1=O

Isomeric SMILES

CC1=CC=C/C(=C\2/C=C(NN2)C(=O)NCC3=CC4=C(C=C3)OCO4)/C1=O

InChI

InChI=1S/C19H17N3O4/c1-11-3-2-4-13(18(11)23)14-8-15(22-21-14)19(24)20-9-12-5-6-16-17(7-12)26-10-25-16/h2-8,21-22H,9-10H2,1H3,(H,20,24)/b14-13+