(3S)-4-azido-3-[[4-[(oxolan-3-ylcarbonylamino)methyl]phenyl]carbonylamino]butanoic acid

Systemtic Name: (3S)-4-azido-3-[[4-[(oxolan-3-ylcarbonylamino)methyl]phenyl]carbonylamino]butanoic acid Openeye Name: (3S)-4-azido-3-[[4-[(tetrahydrofuran-3-carbonylamino)methyl]benzoyl]amino]butanoic acid CAS Name: (3S)-4-azido-3-[[oxo-[4-[[[oxo(3-oxolanyl)methyl]amino]methyl]phenyl]methyl]amino]butanoic acid IUPAC Name: (3S)-4-azido-3-[[4-[(oxolane-3-carbonylamino)methyl]benzoyl]amino]butanoic acid Traditional Name: (3S)-4-azido-3-[[4-[(tetrahydrofuran-3-carbonylamino)methyl]benzoyl]amino]butyric acid Formula: C17H21N5O5 MolecularWeight: 375.37914

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(=O)NCC2=CC=C(C=C2)C(=O)NC(CC(=O)O)CN=[N+]=[N-]

Isomeric SMILES

C1COCC1C(=O)NCC2=CC=C(C=C2)C(=O)N[C@@H](CC(=O)O)CN=[N+]=[N-]

InChI

InChI=1S/C17H21N5O5/c18-22-20-9-14(7-15(23)24)21-17(26)12-3-1-11(2-4-12)8-19-16(25)13-5-6-27-10-13/h1-4,13-14H,5-10H2,(H,19,25)(H,21,26)(H,23,24)/t13?,14-/m0/s1