2-methanidyl-3,3-dimethyl-but-1-ene; palladium(2+); (6Z)-6-[(1-phenylethylamino)methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 2-methanidyl-3,3-dimethyl-but-1-ene; palladium(2+); (6Z)-6-[(1-phenylethylamino)methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 2-methanidyl-3,3-dimethyl-but-1-ene; palladium(2+); (6Z)-6-[(1-phenylethylamino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 2-methanidyl-3,3-dimethyl-1-butene; palladium(2+); (6Z)-6-[(1-phenylethylamino)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 2-methanidyl-3,3-dimethylbut-1-ene; palladium(2+); (6Z)-6-[(1-phenylethylamino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 2-methanidyl-3,3-dimethyl-but-1-ene; palladium(2+); (6Z)-6-[(1-phenylethylamino)methylene]cyclohexa-2,4-dien-1-one Formula: C22H27NOPd MolecularWeight: 427.87588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC=C2C=CC=CC2=O.CC(C)(C)C(=[CH-])[CH2-].[Pd+2]

Isomeric SMILES

CC(C1=CC=CC=C1)N/C=C\2/C=CC=CC2=O.CC(C)(C)C(=[CH-])[CH2-].[Pd+2]

InChI

InChI=1S/C15H15NO.C7H12.Pd/c1-12(13-7-3-2-4-8-13)16-11-14-9-5-6-10-15(14)17;1-6(2)7(3,4)5;/h2-12,16H,1H3;1H,2H2,3-5H3;/q;-2;+2/b14-11-;;