methyl (2R)-3-(1H-indol-3-yl)-2-[2-[(3-nitrophenyl)carbonylamino]ethanoylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[2-[(3-nitrophenyl)carbonylamino]ethanoylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[2-[[(3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propionic acid methyl ester Formula: C21H20N4O6 MolecularWeight: 424.4067

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O6/c1-31-21(28)18(10-14-11-22-17-8-3-2-7-16(14)17)24-19(26)12-23-20(27)13-5-4-6-15(9-13)25(29)30/h2-9,11,18,22H,10,12H2,1H3,(H,23,27)(H,24,26)/t18-/m1/s1