(6Z)-6-(phenylazanylmethylidene)-2-prop-2-enyl-cyclohexa-2,4-dien-1-one; tris(chloranyl)tantalum

Systemtic Name: (6Z)-6-(phenylazanylmethylidene)-2-prop-2-enyl-cyclohexa-2,4-dien-1-one; tris(chloranyl)tantalum Openeye Name: (6Z)-2-allyl-6-(anilinomethylene)cyclohexa-2,4-dien-1-one; trichlorotantalum CAS Name: (6Z)-6-(anilinomethylidene)-2-prop-2-enyl-1-cyclohexa-2,4-dienone; trichlorotantalum IUPAC Name: (6Z)-6-(anilinomethylidene)-2-prop-2-enylcyclohexa-2,4-dien-1-one; trichlorotantalum Traditional Name: (6Z)-2-allyl-6-(anilinomethylene)cyclohexa-2,4-dien-1-one; trichlorotantalum Formula: C16H15Cl3NOTa MolecularWeight: 524.6033

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNC2=CC=CC=C2)C1=O.Cl[Ta](Cl)Cl

Isomeric SMILES

C=CCC1=CC=C/C(=C/NC2=CC=CC=C2)/C1=O.Cl[Ta](Cl)Cl

InChI

InChI=1S/C16H15NO.3ClH.Ta/c1-2-7-13-8-6-9-14(16(13)18)12-17-15-10-4-3-5-11-15;;;;/h2-6,8-12,17H,1,7H2;3*1H;/q;;;;+3/p-3/b14-12-;;;;