methyl (2S)-6-azido-2-[[4-(phenylcarbonyl)phenyl]carbonylamino]hexanoate

Systemtic Name: methyl (2S)-6-azido-2-[[4-(phenylcarbonyl)phenyl]carbonylamino]hexanoate Openeye Name: methyl (2S)-6-azido-2-[(4-benzoylbenzoyl)amino]hexanoate CAS Name: (2S)-6-azido-2-[[(4-benzoylphenyl)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-6-azido-2-[(4-benzoylbenzoyl)amino]hexanoate Traditional Name: (2S)-6-azido-2-[(4-benzoylbenzoyl)amino]hexanoic acid methyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCN=[N+]=[N-])NC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CCCCN=[N+]=[N-])NC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H22N4O4/c1-29-21(28)18(9-5-6-14-23-25-22)24-20(27)17-12-10-16(11-13-17)19(26)15-7-3-2-4-8-15/h2-4,7-8,10-13,18H,5-6,9,14H2,1H3,(H,24,27)/t18-/m0/s1