methanidylbenzene; phenyl-[(Z)-4-phenyliminopent-2-en-2-yl]azanide; zirconium

Systemtic Name: methanidylbenzene; phenyl-[(Z)-4-phenyliminopent-2-en-2-yl]azanide; zirconium Openeye Name: methanidylbenzene; [(Z)-1-methyl-3-phenylimino-but-1-enyl]-phenyl-azanide; zirconium CAS Name: methanidylbenzene; phenyl-[(Z)-4-phenyliminopent-2-en-2-yl]azanide; zirconium IUPAC Name: methanidylbenzene; phenyl-[(Z)-4-phenyliminopent-2-en-2-yl]azanide; zirconium Traditional Name: methanidylbenzene; [(Z)-1-methyl-3-phenylimino-but-1-enyl]-phenyl-azanide; zirconium Formula: C38H38N2Zr-4 MolecularWeight: 613.94572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=NC1=CC=CC=C1)C)[N-]C2=CC=CC=C2.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr]

Isomeric SMILES

C/C(=C/C(=NC1=CC=CC=C1)C)/[N-]C2=CC=CC=C2.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr]

InChI

InChI=1S/C17H17N2.3C7H7.Zr/c1-14(18-16-9-5-3-6-10-16)13-15(2)19-17-11-7-4-8-12-17;3*1-7-5-3-2-4-6-7;/h3-13H,1-2H3;3*2-6H,1H2;/q4*-1;/b14-13-,19-15?;;;;