4-[3-(4-carbamimidoylphenyl)-1,2-oxazol-5-yl]benzenecarboximidamide

Systemtic Name: 4-[3-(4-carbamimidoylphenyl)-1,2-oxazol-5-yl]benzenecarboximidamide Openeye Name: 4-[3-(4-carbamimidoylphenyl)isoxazol-5-yl]benzamidine CAS Name: 4-[3-(4-carbamimidoylphenyl)-5-isoxazolyl]benzenecarboximidamide IUPAC Name: 4-[3-(4-carbamimidoylphenyl)-1,2-oxazol-5-yl]benzenecarboximidamide Traditional Name: 4-[3-(4-amidinophenyl)isoxazol-5-yl]benzamidine Formula: C17H15N5O MolecularWeight: 305.3339

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NO2)C3=CC=C(C=C3)C(=N)N)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NO2)C3=CC=C(C=C3)C(=N)N)C(=N)N

InChI

InChI=1S/C17H15N5O/c18-16(19)12-5-1-10(2-6-12)14-9-15(23-22-14)11-3-7-13(8-4-11)17(20)21/h1-9H,(H3,18,19)(H3,20,21)