(6Z)-4-chloranyl-6-[[(4-methylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one; cobalt

Systemtic Name: (6Z)-4-chloranyl-6-[[(4-methylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one; cobalt Openeye Name: (6Z)-4-chloro-6-[(4-methylanilino)methylene]cyclohexa-2,4-dien-1-one; cobalt CAS Name: (6Z)-4-chloro-6-[(4-methylanilino)methylidene]-1-cyclohexa-2,4-dienone; cobalt IUPAC Name: (6Z)-4-chloro-6-[(4-methylanilino)methylidene]cyclohexa-2,4-dien-1-one; cobalt Traditional Name: (6Z)-4-chloro-6-(p-toluidinomethylene)cyclohexa-2,4-dien-1-one; cobalt Formula: C28H24Cl2CoN2O2 MolecularWeight: 550.34156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC=C2C=C(C=CC2=O)Cl.CC1=CC=C(C=C1)NC=C2C=C(C=CC2=O)Cl.[Co]

Isomeric SMILES

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

InChI

InChI=1S/2C14H12ClNO.Co/c2*1-10-2-5-13(6-3-10)16-9-11-8-12(15)4-7-14(11)17;/h2*2-9,16H,1H3;/b2*11-9-;