[(1R)-1-(3-nitrophenyl)ethyl] 4-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [(1R)-1-(3-nitrophenyl)ethyl] 4-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [(1R)-1-(3-nitrophenyl)ethyl] 4-(thiophene-2-carbonylamino)benzoate CAS Name: 4-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [(1R)-1-(3-nitrophenyl)ethyl] ester IUPAC Name: [(1R)-1-(3-nitrophenyl)ethyl] 4-(thiophene-2-carbonylamino)benzoate Traditional Name: 4-(2-thenoylamino)benzoic acid [(1R)-1-(3-nitrophenyl)ethyl] ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H16N2O5S/c1-13(15-4-2-5-17(12-15)22(25)26)27-20(24)14-7-9-16(10-8-14)21-19(23)18-6-3-11-28-18/h2-13H,1H3,(H,21,23)/t13-/m1/s1