1-(4-bromophenyl)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]pyrazolidine-3,5-dione

Systemtic Name: 1-(4-bromophenyl)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]pyrazolidine-3,5-dione Openeye Name: 1-(4-bromophenyl)-4-[(4-hydroxy-3-methoxy-phenyl)methylene]pyrazolidine-3,5-dione CAS Name: 1-(4-bromophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]pyrazolidine-3,5-dione IUPAC Name: 1-(4-bromophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]pyrazolidine-3,5-dione Traditional Name: 1-(4-bromophenyl)-4-vanillylidene-pyrazolidine-3,5-quinone Formula: C17H13BrN2O4 MolecularWeight: 389.20012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)Br)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C17H13BrN2O4/c1-24-15-9-10(2-7-14(15)21)8-13-16(22)19-20(17(13)23)12-5-3-11(18)4-6-12/h2-9,21H,1H3,(H,19,22)