chromium; (6E)-2-methoxy-6-[[(4-methylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: chromium; (6E)-2-methoxy-6-[[(4-methylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: chromium; (6E)-2-methoxy-6-[(4-methylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: chromium; (6E)-2-methoxy-6-[(4-methylanilino)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: chromium; (6E)-2-methoxy-6-[(4-methylanilino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: chromium; (6E)-2-methoxy-6-(p-toluidinomethylene)cyclohexa-2,4-dien-1-one Formula: C45H45CrN3O6 MolecularWeight: 775.8514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC=C2C=CC=C(C2=O)OC.CC1=CC=C(C=C1)NC=C2C=CC=C(C2=O)OC.CC1=CC=C(C=C1)NC=C2C=CC=C(C2=O)OC.[Cr]

Isomeric SMILES

CC1=CC=C(C=C1)N/C=C\2/C(=O)C(=CC=C2)OC.CC1=CC=C(C=C1)N/C=C\2/C(=O)C(=CC=C2)OC.CC1=CC=C(C=C1)N/C=C\2/C(=O)C(=CC=C2)OC.[Cr]

InChI

InChI=1S/3C15H15NO2.Cr/c3*1-11-6-8-13(9-7-11)16-10-12-4-3-5-14(18-2)15(12)17;/h3*3-10,16H,1-2H3;/b3*12-10+;