[3-(4-nitrophenoxy)phenyl]methyl 2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoate

Systemtic Name: [3-(4-nitrophenoxy)phenyl]methyl 2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoate Openeye Name: [3-(4-nitrophenoxy)phenyl]methyl 2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetate CAS Name: 2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]acetic acid [3-(4-nitrophenoxy)phenyl]methyl ester IUPAC Name: [3-(4-nitrophenoxy)phenyl]methyl 2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetate Traditional Name: 2-[[2-(2-thenoylamino)acetyl]amino]acetic acid [3-(4-nitrophenoxy)benzyl] ester Formula: C22H19N3O7S MolecularWeight: 469.46716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-])COC(=O)CNC(=O)CNC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-])COC(=O)CNC(=O)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C22H19N3O7S/c26-20(12-24-22(28)19-5-2-10-33-19)23-13-21(27)31-14-15-3-1-4-18(11-15)32-17-8-6-16(7-9-17)25(29)30/h1-11H,12-14H2,(H,23,26)(H,24,28)