2-[(4-carbamimidoylphenyl)sulfonylamino]propyl 2-phenoxyethanoate ethanoate

Systemtic Name: 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl 2-phenoxyethanoate ethanoate Openeye Name: 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl 2-phenoxyacetate acetate CAS Name: 2-phenoxyacetic acid 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl ester acetate IUPAC Name: 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl 2-phenoxyacetate acetate Traditional Name: 2-phenoxyacetic acid 2-[(4-amidinophenyl)sulfonylamino]propyl ester acetate Formula: C20H24N3O7S- MolecularWeight: 450.48546

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)COC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=N)N.CC(=O)[O-]

Isomeric SMILES

CC(COC(=O)COC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=N)N.CC(=O)[O-]

InChI

InChI=1S/C18H21N3O5S.C2H4O2/c1-13(11-26-17(22)12-25-15-5-3-2-4-6-15)21-27(23,24)16-9-7-14(8-10-16)18(19)20;1-2(3)4/h2-10,13,21H,11-12H2,1H3,(H3,19,20);1H3,(H,3,4)/p-1