N-[2-[(3-fluoranyl-4-nitro-phenyl)methylamino]-2-oxidanylidene-ethyl]-3-(4-hydroxyphenyl)propanamide

Systemtic Name: N-[2-[(3-fluoranyl-4-nitro-phenyl)methylamino]-2-oxidanylidene-ethyl]-3-(4-hydroxyphenyl)propanamide Openeye Name: N-[2-[(3-fluoro-4-nitro-phenyl)methylamino]-2-oxo-ethyl]-3-(4-hydroxyphenyl)propanamide CAS Name: N-[2-[(3-fluoro-4-nitrophenyl)methylamino]-2-oxoethyl]-3-(4-hydroxyphenyl)propanamide IUPAC Name: N-[2-[(3-fluoro-4-nitrophenyl)methylamino]-2-oxoethyl]-3-(4-hydroxyphenyl)propanamide Traditional Name: N-[2-[(3-fluoro-4-nitro-benzyl)amino]-2-keto-ethyl]-3-(4-hydroxyphenyl)propionamide Formula: C18H18FN3O5 MolecularWeight: 375.351023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)NCC(=O)NCC2=CC(=C(C=C2)[N+](=O)[O-])F)O

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)NCC(=O)NCC2=CC(=C(C=C2)[N+](=O)[O-])F)O

InChI

InChI=1S/C18H18FN3O5/c19-15-9-13(3-7-16(15)22(26)27)10-20-18(25)11-21-17(24)8-4-12-1-5-14(23)6-2-12/h1-3,5-7,9,23H,4,8,10-11H2,(H,20,25)(H,21,24)