ethyl 4-(cyclopentylcarbonylamino)benzoate; iron

Systemtic Name: ethyl 4-(cyclopentylcarbonylamino)benzoate; iron Openeye Name: ethyl 4-(cyclopentanecarbonylamino)benzoate; iron CAS Name: 4-[[cyclopentyl(oxo)methyl]amino]benzoic acid ethyl ester; iron IUPAC Name: ethyl 4-(cyclopentanecarbonylamino)benzoate; iron Traditional Name: 4-(cyclopentanecarbonylamino)benzoic acid ethyl ester; iron Formula: C30H28FeN2O6 MolecularWeight: 568.39812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C]2[CH][CH][CH][CH]2.CCOC(=O)C1=CC=C(C=C1)NC(=O)[C]2[CH][CH][CH][CH]2.[Fe]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C]2[CH][CH][CH][CH]2.CCOC(=O)C1=CC=C(C=C1)NC(=O)[C]2[CH][CH][CH][CH]2.[Fe]

InChI

InChI=1S/2C15H14NO3.Fe/c2*1-2-19-15(18)12-7-9-13(10-8-12)16-14(17)11-5-3-4-6-11;/h2*3-10H,2H2,1H3,(H,16,17);