2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl 4-nitrobenzoate

Systemtic Name: 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl 4-nitrobenzoate Openeye Name: 2-[[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]ethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl ester IUPAC Name: 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-[[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]ethyl ester Formula: C19H19F3N2O4 MolecularWeight: 396.36037

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)C(F)(F)F)NCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(CC1=CC(=CC=C1)C(F)(F)F)NCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H19F3N2O4/c1-13(11-14-3-2-4-16(12-14)19(20,21)22)23-9-10-28-18(25)15-5-7-17(8-6-15)24(26)27/h2-8,12-13,23H,9-11H2,1H3