5-azanyl-2-[2-(4-nitrophenyl)sulfonylethoxycarbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-(4-nitrophenyl)sulfonylethoxycarbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[2-(4-nitrophenyl)sulfonylethoxycarbonylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-(4-nitrophenyl)sulfonylethoxy-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[2-(4-nitrophenyl)sulfonylethoxycarbonylamino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-(2-nosylethoxycarbonylamino)valeric acid Formula: C14H17N3O9S MolecularWeight: 403.36448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)CCOC(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)CCOC(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C14H17N3O9S/c15-12(18)6-5-11(13(19)20)16-14(21)26-7-8-27(24,25)10-3-1-9(2-4-10)17(22)23/h1-4,11H,5-8H2,(H2,15,18)(H,16,21)(H,19,20)