ethyl 2-[[(2S)-2-[(2-azidophenyl)carbonylamino]-3-methyl-butanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[(2S)-2-[(2-azidophenyl)carbonylamino]-3-methyl-butanoyl]amino]ethanoate Openeye Name: ethyl 2-[[(2S)-2-[(2-azidobenzoyl)amino]-3-methyl-butanoyl]amino]acetate CAS Name: 2-[[(2S)-2-[[(2-azidophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(2S)-2-[(2-azidobenzoyl)amino]-3-methylbutanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-[(2-azidobenzoyl)amino]-3-methyl-butanoyl]amino]acetic acid ethyl ester Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(C(C)C)NC(=O)C1=CC=CC=C1N=[N+]=[N-]

Isomeric SMILES

CCOC(=O)CNC(=O)[C@H](C(C)C)NC(=O)C1=CC=CC=C1N=[N+]=[N-]

InChI

InChI=1S/C16H21N5O4/c1-4-25-13(22)9-18-16(24)14(10(2)3)19-15(23)11-7-5-6-8-12(11)20-21-17/h5-8,10,14H,4,9H2,1-3H3,(H,18,24)(H,19,23)/t14-/m0/s1