(3S)-4-azido-3-[[4-(phenylmethoxycarbonylaminomethyl)phenyl]carbonylamino]butanoic acid

Systemtic Name: (3S)-4-azido-3-[[4-(phenylmethoxycarbonylaminomethyl)phenyl]carbonylamino]butanoic acid Openeye Name: (3S)-4-azido-3-[[4-(benzyloxycarbonylaminomethyl)benzoyl]amino]butanoic acid CAS Name: (3S)-4-azido-3-[[oxo-[4-(phenylmethoxycarbonylaminomethyl)phenyl]methyl]amino]butanoic acid IUPAC Name: (3S)-4-azido-3-[[4-(phenylmethoxycarbonylaminomethyl)benzoyl]amino]butanoic acid Traditional Name: (3S)-4-azido-3-[[4-(benzyloxycarbonylaminomethyl)benzoyl]amino]butyric acid Formula: C20H21N5O5 MolecularWeight: 411.41124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC(CC(=O)O)CN=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)N[C@@H](CC(=O)O)CN=[N+]=[N-]

InChI

InChI=1S/C20H21N5O5/c21-25-23-12-17(10-18(26)27)24-19(28)16-8-6-14(7-9-16)11-22-20(29)30-13-15-4-2-1-3-5-15/h1-9,17H,10-13H2,(H,22,29)(H,24,28)(H,26,27)/t17-/m0/s1