N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoranyl-6-(3-nitrophenyl)phenyl]-2-methoxy-ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoranyl-6-(3-nitrophenyl)phenyl]-2-methoxy-ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoro-6-(3-nitrophenyl)phenyl]-2-methoxy-acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoro-6-(3-nitrophenyl)phenyl]-2-methoxyacetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoro-6-(3-nitrophenyl)phenyl]-2-methoxyacetamide Traditional Name: N-(4-amidinobenzyl)-2-[2-fluoro-6-(3-nitrophenyl)phenyl]-2-methoxy-acetamide Formula: C23H21FN4O4 MolecularWeight: 436.435643

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=C(C=CC=C1F)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(C1=C(C=CC=C1F)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H21FN4O4/c1-32-21(23(29)27-13-14-8-10-15(11-9-14)22(25)26)20-18(6-3-7-19(20)24)16-4-2-5-17(12-16)28(30)31/h2-12,21H,13H2,1H3,(H3,25,26)(H,27,29)