(2-nitrophenyl) (4-carbamimidoylphenyl)methanesulfonate

Systemtic Name: (2-nitrophenyl) (4-carbamimidoylphenyl)methanesulfonate Openeye Name: (2-nitrophenyl) (4-carbamimidoylphenyl)methanesulfonate CAS Name: (4-carbamimidoylphenyl)methanesulfonic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) (4-carbamimidoylphenyl)methanesulfonate Traditional Name: (4-amidinophenyl)methanesulfonic acid (2-nitrophenyl) ester Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])OS(=O)(=O)CC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])OS(=O)(=O)CC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C14H13N3O5S/c15-14(16)11-7-5-10(6-8-11)9-23(20,21)22-13-4-2-1-3-12(13)17(18)19/h1-8H,9H2,(H3,15,16)