(2-nitrophenyl)methyl 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: (2-nitrophenyl)methyl 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: (2-nitrophenyl)methyl 3-(1H-indol-3-yl)-2-(thiophene-2-carbonylamino)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 3-(1H-indol-3-yl)-2-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-(2-thenoylamino)propionic acid (2-nitrobenzyl) ester Formula: C23H19N3O5S MolecularWeight: 449.47906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O5S/c27-22(21-10-5-11-32-21)25-19(12-16-13-24-18-8-3-2-7-17(16)18)23(28)31-14-15-6-1-4-9-20(15)26(29)30/h1-11,13,19,24H,12,14H2,(H,25,27)