3-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-3-thiophen-3-yl-propanoic acid

Systemtic Name: 3-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-3-thiophen-3-yl-propanoic acid Openeye Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-3-(3-thienyl)propanoic acid CAS Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-3-(3-thiophenyl)propanoic acid IUPAC Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-3-thiophen-3-ylpropanoic acid Traditional Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-3-(3-thienyl)propionic acid Formula: C15H15N3O4S MolecularWeight: 333.3623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(NC(CC(=O)O)C2=CSC=C2)N=O)NO

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(/NC(CC(=O)O)C2=CSC=C2)\N=O)/NO

InChI

InChI=1S/C15H15N3O4S/c19-13(20)8-12(11-6-7-23-9-11)16-15(18-22)14(17-21)10-4-2-1-3-5-10/h1-7,9,12,16-17,21H,8H2,(H,19,20)/b15-14+