1,3-bis[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]propan-2-yl benzoate; copper

Systemtic Name: 1,3-bis[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]propan-2-yl benzoate; copper Openeye Name: copper; [2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1-[[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]methyl]ethyl] benzoate CAS Name: benzoic acid 1,3-bis[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]propan-2-yl ester; copper IUPAC Name: 1,3-bis[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]propan-2-yl benzoate; copper Traditional Name: benzoic acid [2-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]-1-[[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]methyl]ethyl] ester; copper Formula: C24H22CuN2O4 MolecularWeight: 465.98848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(CNC=C2C=CC=CC2=O)CNC=C3C=CC=CC3=O.[Cu]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC(CNC=C2C=CC=CC2=O)CNC=C3C=CC=CC3=O.[Cu]

InChI

InChI=1S/C24H22N2O4.Cu/c27-22-12-6-4-10-19(22)14-25-16-21(30-24(29)18-8-2-1-3-9-18)17-26-15-20-11-5-7-13-23(20)28;/h1-15,21,25-26H,16-17H2;