1-(3-bromophenyl)-4-[[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene]pyrazolidine-3,5-dione

Systemtic Name: 1-(3-bromophenyl)-4-[[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene]pyrazolidine-3,5-dione Openeye Name: 1-(3-bromophenyl)-4-[(4-isobutoxy-3-methoxy-phenyl)methylene]pyrazolidine-3,5-dione CAS Name: 1-(3-bromophenyl)-4-[[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene]pyrazolidine-3,5-dione IUPAC Name: 1-(3-bromophenyl)-4-[[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene]pyrazolidine-3,5-dione Traditional Name: 1-(3-bromophenyl)-4-(4-isobutoxy-3-methoxy-benzylidene)pyrazolidine-3,5-quinone Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2O4/c1-13(2)12-28-18-8-7-14(10-19(18)27-3)9-17-20(25)23-24(21(17)26)16-6-4-5-15(22)11-16/h4-11,13H,12H2,1-3H3,(H,23,25)