(4Z)-4-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylidene]-5-methylidene-2-phenyl-pyrazolidin-3-one

Systemtic Name: (4Z)-4-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylidene]-5-methylidene-2-phenyl-pyrazolidin-3-one Openeye Name: (4Z)-4-[(3-bromo-5-methoxy-4-propoxy-phenyl)methylene]-5-methylene-2-phenyl-pyrazolidin-3-one CAS Name: (4Z)-4-[(3-bromo-5-methoxy-4-propoxyphenyl)methylidene]-5-methylene-2-phenyl-3-pyrazolidinone IUPAC Name: (4Z)-4-[(3-bromo-5-methoxy-4-propoxyphenyl)methylidene]-5-methylidene-2-phenylpyrazolidin-3-one Traditional Name: (4Z)-4-(3-bromo-5-methoxy-4-propoxy-benzylidene)-5-methylene-2-phenyl-pyrazolidin-3-one Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C2C(=C)NN(C2=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=C\2/C(=C)NN(C2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H21BrN2O3/c1-4-10-27-20-18(22)12-15(13-19(20)26-3)11-17-14(2)23-24(21(17)25)16-8-6-5-7-9-16/h5-9,11-13,23H,2,4,10H2,1,3H3/b17-11-