(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-chloranyl-4-methyl-phenyl)pyrazolidine-3,5-dione

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-chloranyl-4-methyl-phenyl)pyrazolidine-3,5-dione Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-1-(3-chloro-4-methyl-phenyl)pyrazolidine-3,5-dione CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-chloro-4-methylphenyl)pyrazolidine-3,5-dione IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-chloro-4-methylphenyl)pyrazolidine-3,5-dione Traditional Name: (4Z)-1-(3-chloro-4-methyl-phenyl)-4-piperonylidene-pyrazolidine-3,5-quinone Formula: C18H13ClN2O4 MolecularWeight: 356.75982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)C(=O)N2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)/C(=C\C3=CC4=C(C=C3)OCO4)/C(=O)N2)Cl

InChI

InChI=1S/C18H13ClN2O4/c1-10-2-4-12(8-14(10)19)21-18(23)13(17(22)20-21)6-11-3-5-15-16(7-11)25-9-24-15/h2-8H,9H2,1H3,(H,20,22)/b13-6-