[[azanyl-[3,5-bis(trifluoromethyl)phenyl]methylidene]amino] propanoate

Systemtic Name: [[azanyl-[3,5-bis(trifluoromethyl)phenyl]methylidene]amino] propanoate Openeye Name: [[amino-[3,5-bis(trifluoromethyl)phenyl]methylene]amino] propanoate CAS Name: propanoic acid [[amino-[3,5-bis(trifluoromethyl)phenyl]methylidene]amino] ester IUPAC Name: [[amino-[3,5-bis(trifluoromethyl)phenyl]methylidene]amino] propanoate Traditional Name: propionic acid [[amino-[3,5-bis(trifluoromethyl)phenyl]methylene]amino] ester Formula: C12H10F6N2O2 MolecularWeight: 328.210419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON=C(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)N

Isomeric SMILES

CCC(=O)ON=C(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)N

InChI

InChI=1S/C12H10F6N2O2/c1-2-9(21)22-20-10(19)6-3-7(11(13,14)15)5-8(4-6)12(16,17)18/h3-5H,2H2,1H3,(H2,19,20)