2-azido-3-[[2-[[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-phenyl-ethanoyl]amino]-4-oxidanylidene-azetidine-1-sulfonate

Systemtic Name: 2-azido-3-[[2-[[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-phenyl-ethanoyl]amino]-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: 2-azido-3-[[2-[(4-ethyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-phenyl-acetyl]amino]-4-oxo-azetidine-1-sulfonate CAS Name: 2-azido-3-[[2-[[(4-ethyl-2,3-dioxo-1-piperazinyl)-oxomethyl]amino]-1-oxo-2-phenylethyl]amino]-4-oxo-1-azetidinesulfonate IUPAC Name: 2-azido-3-[[2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-4-oxoazetidine-1-sulfonate Traditional Name: 2-azido-3-[[2-[(4-ethyl-2,3-diketo-piperazine-1-carbonyl)amino]-2-phenyl-acetyl]amino]-4-keto-azetidine-1-sulfonate Formula: C18H19N8O8S- MolecularWeight: 507.45726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3C(N(C3=O)S(=O)(=O)[O-])N=[N+]=[N-]

Isomeric SMILES

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3C(N(C3=O)S(=O)(=O)[O-])N=[N+]=[N-]

InChI

InChI=1S/C18H20N8O8S/c1-2-24-8-9-25(17(30)16(24)29)18(31)21-11(10-6-4-3-5-7-10)14(27)20-12-13(22-23-19)26(15(12)28)35(32,33)34/h3-7,11-13H,2,8-9H2,1H3,(H,20,27)(H,21,31)(H,32,33,34)/p-1