3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-phenyl]-N-(3-bromophenyl)-2-cyano-prop-2-enamide

Systemtic Name: 3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-phenyl]-N-(3-bromophenyl)-2-cyano-prop-2-enamide Openeye Name: 3-[4-(2-amino-2-oxo-ethoxy)-3-chloro-phenyl]-N-(3-bromophenyl)-2-cyano-prop-2-enamide CAS Name: 3-[4-(2-amino-2-oxoethoxy)-3-chlorophenyl]-N-(3-bromophenyl)-2-cyano-2-propenamide IUPAC Name: 3-[4-(2-amino-2-oxoethoxy)-3-chlorophenyl]-N-(3-bromophenyl)-2-cyanoprop-2-enamide Traditional Name: 3-[4-(2-amino-2-keto-ethoxy)-3-chloro-phenyl]-N-(3-bromophenyl)-2-cyano-acrylamide Formula: C18H13BrClN3O3 MolecularWeight: 434.67112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)C(=CC2=CC(=C(C=C2)OCC(=O)N)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)C(=CC2=CC(=C(C=C2)OCC(=O)N)Cl)C#N

InChI

InChI=1S/C18H13BrClN3O3/c19-13-2-1-3-14(8-13)23-18(25)12(9-21)6-11-4-5-16(15(20)7-11)26-10-17(22)24/h1-8H,10H2,(H2,22,24)(H,23,25)