(E)-3-(aminocarbonylamino)-N-(4-nitrophenyl)sulfonyl-3-pyridin-1-ium-1-yl-prop-2-enamide

Systemtic Name: (E)-3-(aminocarbonylamino)-N-(4-nitrophenyl)sulfonyl-3-pyridin-1-ium-1-yl-prop-2-enamide Openeye Name: (E)-N-(4-nitrophenyl)sulfonyl-3-pyridin-1-ium-1-yl-3-ureido-prop-2-enamide CAS Name: (E)-3-(carbamoylamino)-N-(4-nitrophenyl)sulfonyl-3-(1-pyridin-1-iumyl)-2-propenamide IUPAC Name: (E)-3-(carbamoylamino)-N-(4-nitrophenyl)sulfonyl-3-pyridin-1-ium-1-ylprop-2-enamide Traditional Name: (E)-N-nosyl-3-pyridin-1-ium-1-yl-3-ureido-acrylamide Formula: C15H14N5O6S+ MolecularWeight: 392.36656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(=CC(=O)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)N

Isomeric SMILES

C1=CC=[N+](C=C1)/C(=C/C(=O)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])/NC(=O)N

InChI

InChI=1S/C15H13N5O6S/c16-15(22)17-13(19-8-2-1-3-9-19)10-14(21)18-27(25,26)12-6-4-11(5-7-12)20(23)24/h1-10H,(H3-,16,17,18,21,22)/p+1