N-[(5-nitro-2-oxidanyl-phenyl)methyl]-3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanamide

Systemtic Name: N-[(5-nitro-2-oxidanyl-phenyl)methyl]-3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-3-(2-oxothiazolidin-3-yl)propanamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-(2-oxo-3-thiazolidinyl)propanamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-3-(2-ketothiazolidin-3-yl)propionamide Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)N1CCC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1CSC(=O)N1CCC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H15N3O5S/c17-11-2-1-10(16(20)21)7-9(11)8-14-12(18)3-4-15-5-6-22-13(15)19/h1-2,7,17H,3-6,8H2,(H,14,18)