methyl (2S)-2-[[(2S)-2-[(2-azidophenyl)carbonylamino]propanoyl]amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-[(2-azidophenyl)carbonylamino]propanoyl]amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2S)-2-[[(2S)-2-[(2-azidobenzoyl)amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[(2S)-2-[[(2-azidophenyl)-oxomethyl]amino]-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-[(2-azidobenzoyl)amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[[(2S)-2-[(2-azidobenzoyl)amino]propanoyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C22H22N6O4 MolecularWeight: 434.44788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)NC(=O)C3=CC=CC=C3N=[N+]=[N-]

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OC)NC(=O)C3=CC=CC=C3N=[N+]=[N-]

InChI

InChI=1S/C22H22N6O4/c1-13(25-21(30)16-8-4-6-10-18(16)27-28-23)20(29)26-19(22(31)32-2)11-14-12-24-17-9-5-3-7-15(14)17/h3-10,12-13,19,24H,11H2,1-2H3,(H,25,30)(H,26,29)/t13-,19-/m0/s1