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

Systemtic Name: 4-[5-(3-carbamimidoylphenyl)-1,2-oxazol-3-yl]-3-chloranyl-benzenecarboximidamide Openeye Name: 4-[5-(3-carbamimidoylphenyl)isoxazol-3-yl]-3-chloro-benzamidine CAS Name: 4-[5-(3-carbamimidoylphenyl)-3-isoxazolyl]-3-chlorobenzenecarboximidamide IUPAC Name: 4-[5-(3-carbamimidoylphenyl)-1,2-oxazol-3-yl]-3-chlorobenzenecarboximidamide Traditional Name: 4-[5-(3-amidinophenyl)isoxazol-3-yl]-3-chloro-benzamidine Formula: C17H14ClN5O MolecularWeight: 339.77896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=N)N)C2=CC(=NO2)C3=C(C=C(C=C3)C(=N)N)Cl

Isomeric SMILES

C1=CC(=CC(=C1)C(=N)N)C2=CC(=NO2)C3=C(C=C(C=C3)C(=N)N)Cl

InChI

InChI=1S/C17H14ClN5O/c18-13-7-11(17(21)22)4-5-12(13)14-8-15(24-23-14)9-2-1-3-10(6-9)16(19)20/h1-8H,(H3,19,20)(H3,21,22)