(E)-3-(5-azanyl-2-oxidanyl-phenyl)-N-[2-chloranyl-4-(2-hydroxyethylamino)-5-nitro-phenyl]prop-2-enamide

Systemtic Name: (E)-3-(5-azanyl-2-oxidanyl-phenyl)-N-[2-chloranyl-4-(2-hydroxyethylamino)-5-nitro-phenyl]prop-2-enamide Openeye Name: (E)-3-(5-amino-2-hydroxy-phenyl)-N-[2-chloro-4-(2-hydroxyethylamino)-5-nitro-phenyl]prop-2-enamide CAS Name: (E)-3-(5-amino-2-hydroxyphenyl)-N-[2-chloro-4-(2-hydroxyethylamino)-5-nitrophenyl]-2-propenamide IUPAC Name: (E)-3-(5-amino-2-hydroxyphenyl)-N-[2-chloro-4-(2-hydroxyethylamino)-5-nitrophenyl]prop-2-enamide Traditional Name: (E)-3-(5-amino-2-hydroxy-phenyl)-N-[2-chloro-4-(2-hydroxyethylamino)-5-nitro-phenyl]acrylamide Formula: C17H17ClN4O5 MolecularWeight: 392.79368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C=CC(=O)NC2=CC(=C(C=C2Cl)NCCO)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1N)/C=C/C(=O)NC2=CC(=C(C=C2Cl)NCCO)[N+](=O)[O-])O

InChI

InChI=1S/C17H17ClN4O5/c18-12-8-14(20-5-6-23)15(22(26)27)9-13(12)21-17(25)4-1-10-7-11(19)2-3-16(10)24/h1-4,7-9,20,23-24H,5-6,19H2,(H,21,25)/b4-1+