(4Z)-1-(4-bromophenyl)-4-[(2,3-dimethyl-4-propoxy-phenyl)methylidene]pyrazolidine-3,5-dione

Systemtic Name: (4Z)-1-(4-bromophenyl)-4-[(2,3-dimethyl-4-propoxy-phenyl)methylidene]pyrazolidine-3,5-dione Openeye Name: (4Z)-1-(4-bromophenyl)-4-[(2,3-dimethyl-4-propoxy-phenyl)methylene]pyrazolidine-3,5-dione CAS Name: (4Z)-1-(4-bromophenyl)-4-[(2,3-dimethyl-4-propoxyphenyl)methylidene]pyrazolidine-3,5-dione IUPAC Name: (4Z)-1-(4-bromophenyl)-4-[(2,3-dimethyl-4-propoxyphenyl)methylidene]pyrazolidine-3,5-dione Traditional Name: (4Z)-1-(4-bromophenyl)-4-(2,3-dimethyl-4-propoxy-benzylidene)pyrazolidine-3,5-quinone Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C(=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)Br)C)C

Isomeric SMILES

CCCOC1=C(C(=C(C=C1)/C=C\2/C(=O)NN(C2=O)C3=CC=C(C=C3)Br)C)C

InChI

InChI=1S/C21H21BrN2O3/c1-4-11-27-19-10-5-15(13(2)14(19)3)12-18-20(25)23-24(21(18)26)17-8-6-16(22)7-9-17/h5-10,12H,4,11H2,1-3H3,(H,23,25)/b18-12-