ethyl 2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]pentanoate

Systemtic Name: ethyl 2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]pentanoate Openeye Name: ethyl 2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]pentanoate CAS Name: 2-[[4-methoxy-3-[oxo-[[4-(trifluoromethyl)phenyl]methylamino]methyl]phenyl]methyl]pentanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methylcarbamoyl]phenyl]methyl]pentanoate Traditional Name: 2-[4-methoxy-3-[[4-(trifluoromethyl)benzyl]carbamoyl]benzyl]valeric acid ethyl ester Formula: C24H28F3NO4 MolecularWeight: 451.47863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCCC(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C24H28F3NO4/c1-4-6-18(23(30)32-5-2)13-17-9-12-21(31-3)20(14-17)22(29)28-15-16-7-10-19(11-8-16)24(25,26)27/h7-12,14,18H,4-6,13,15H2,1-3H3,(H,28,29)