ethyl (Z)-4-oxidanylidene-4-phenyl-2-phenylazanyl-but-2-enoate; tris(chloranyl)zirconium

Systemtic Name: ethyl (Z)-4-oxidanylidene-4-phenyl-2-phenylazanyl-but-2-enoate; tris(chloranyl)zirconium Openeye Name: ethyl (Z)-2-anilino-4-oxo-4-phenyl-but-2-enoate; trichlorozirconium CAS Name: (Z)-2-anilino-4-oxo-4-phenyl-2-butenoic acid ethyl ester; trichlorozirconium IUPAC Name: ethyl (Z)-2-anilino-4-oxo-4-phenylbut-2-enoate; trichlorozirconium Traditional Name: (Z)-2-anilino-4-keto-4-phenyl-but-2-enoic acid ethyl ester; trichlorozirconium Formula: C18H17Cl3NO3Zr MolecularWeight: 492.91548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(=O)C1=CC=CC=C1)NC2=CC=CC=C2.Cl[Zr](Cl)Cl

Isomeric SMILES

CCOC(=O)/C(=C/C(=O)C1=CC=CC=C1)/NC2=CC=CC=C2.Cl[Zr](Cl)Cl

InChI

InChI=1S/C18H17NO3.3ClH.Zr/c1-2-22-18(21)16(19-15-11-7-4-8-12-15)13-17(20)14-9-5-3-6-10-14;;;;/h3-13,19H,2H2,1H3;3*1H;/q;;;;+3/p-3/b16-13-;;;;