ethylbenzene; 1-[3-[[4-[(4-methylphenyl)diazenyl]phenyl]methyl]-5-phenylcarbonyl-phenyl]ethanone; yttrium(3+)

Systemtic Name: ethylbenzene; 1-[3-[[4-[(4-methylphenyl)diazenyl]phenyl]methyl]-5-phenylcarbonyl-phenyl]ethanone; yttrium(3+) Openeye Name: 1-[3-(benzoyl)-5-[[4-(p-tolylazo)phenyl]methyl]phenyl]ethanone; ethylbenzene; yttrium(3+) CAS Name: ethylbenzene; 1-[3-[[4-(4-methylphenyl)azophenyl]methyl]-5-[oxo(phenyl)methyl]phenyl]ethanone; yttrium(3+) IUPAC Name: 1-[3-(benzoyl)-5-[[4-[(4-methylphenyl)diazenyl]phenyl]methyl]phenyl]ethanone; ethylbenzene; yttrium(3+) Traditional Name: 1-[3-(benzoyl)-5-[4-(p-tolylazo)benzyl]phenyl]ethanone; ethylbenzene; yttrium(3+) Formula: C37H32N2O2Y+ MolecularWeight: 625.56803

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[C-]C=C1.CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)CC3=CC(=CC(=C3)C(=O)C)C(=O)C4=CC=[C-]C=C4.[Y+3]

Isomeric SMILES

CCC1=CC=[C-]C=C1.CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)CC3=CC(=CC(=C3)C(=O)C)C(=O)C4=CC=[C-]C=C4.[Y+3]

InChI

InChI=1S/C29H23N2O2.C8H9.Y/c1-20-8-12-27(13-9-20)30-31-28-14-10-22(11-15-28)16-23-17-25(21(2)32)19-26(18-23)29(33)24-6-4-3-5-7-24;1-2-8-6-4-3-5-7-8;/h4-15,17-19H,16H2,1-2H3;4-7H,2H2,1H3;/q2*-1;+3