iridium; 7-methyl-1-(4-methylbenzene-6-id-1-yl)phthalazine; (Z)-4-oxidanylpent-3-en-2-one

Systemtic Name: iridium; 7-methyl-1-(4-methylbenzene-6-id-1-yl)phthalazine; (Z)-4-oxidanylpent-3-en-2-one Openeye Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 7-methyl-1-(4-methylbenzene-6-id-1-yl)phthalazine CAS Name: (Z)-4-hydroxy-3-penten-2-one; iridium; 7-methyl-1-(4-methyl-1-benzene-6-idyl)phthalazine IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 7-methyl-1-(4-methylbenzene-6-id-1-yl)phthalazine Traditional Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 7-methyl-1-(4-methylbenzene-6-id-1-yl)phthalazine Formula: C21H21IrN2O2- MolecularWeight: 525.62064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N=NC=C2C=C1)C3=CC=C(C=[C-]3)C.CC(=CC(=O)C)O.[Ir]

Isomeric SMILES

CC1=CC2=C(N=NC=C2C=C1)C3=CC=C(C=[C-]3)C.C/C(=C/C(=O)C)/O.[Ir]

InChI

InChI=1S/C16H13N2.C5H8O2.Ir/c1-11-3-6-13(7-4-11)16-15-9-12(2)5-8-14(15)10-17-18-16;1-4(6)3-5(2)7;/h3-6,8-10H,1-2H3;3,6H,1-2H3;/q-1;;/b;4-3-;