N-[4-(1-azido-3-methyl-1-oxidanylidene-butan-2-yl)-3-oxidanylidene-azetidin-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[4-(1-azido-3-methyl-1-oxidanylidene-butan-2-yl)-3-oxidanylidene-azetidin-2-yl]-2-phenyl-ethanamide Openeye Name: 3-methyl-2-[3-oxo-4-[(2-phenylacetyl)amino]azetidin-2-yl]butanoyl azide CAS Name: N-[4-(1-azido-3-methyl-1-oxobutan-2-yl)-3-oxo-2-azetidinyl]-2-phenylacetamide IUPAC Name: 3-methyl-2-[3-oxo-4-[(2-phenylacetyl)amino]azetidin-2-yl]butanoyl azide Traditional Name: N-[4-(1-carbonazidoyl-2-methyl-propyl)-3-keto-azetidin-2-yl]-2-phenyl-acetamide Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1C(=O)C(N1)NC(=O)CC2=CC=CC=C2)C(=O)N=[N+]=[N-]

Isomeric SMILES

CC(C)C(C1C(=O)C(N1)NC(=O)CC2=CC=CC=C2)C(=O)N=[N+]=[N-]

InChI

InChI=1S/C16H19N5O3/c1-9(2)12(16(24)20-21-17)13-14(23)15(19-13)18-11(22)8-10-6-4-3-5-7-10/h3-7,9,12-13,15,19H,8H2,1-2H3,(H,18,22)