[5-(azaniumylmethyl)-2-methoxy-phenyl]sulfonyl-(2-cyanophenyl)azanide

Systemtic Name: [5-(azaniumylmethyl)-2-methoxy-phenyl]sulfonyl-(2-cyanophenyl)azanide Openeye Name: [5-(azaniumylmethyl)-2-methoxy-phenyl]sulfonyl-(2-cyanophenyl)azanide CAS Name: [5-(ammoniomethyl)-2-methoxyphenyl]sulfonyl-(2-cyanophenyl)azanide IUPAC Name: [5-(azaniumylmethyl)-2-methoxyphenyl]sulfonyl-(2-cyanophenyl)azanide Traditional Name: [5-(ammoniomethyl)-2-methoxy-phenyl]sulfonyl-(2-cyanophenyl)azanide Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)[N-]C2=CC=CC=C2C#N

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)[N-]C2=CC=CC=C2C#N

InChI

InChI=1S/C15H14N3O3S/c1-21-14-7-6-11(9-16)8-15(14)22(19,20)18-13-5-3-2-4-12(13)10-17/h2-8H,9,16H2,1H3/q-1/p+1