2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-amidinophenyl)sulfonylamino]ethyl]-2-methoxy-phenoxy]acetic acid Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N)OCC(=O)O

InChI

InChI=1S/C18H21N3O6S/c1-26-16-10-12(2-7-15(16)27-11-17(22)23)8-9-21-28(24,25)14-5-3-13(4-6-14)18(19)20/h2-7,10,21H,8-9,11H2,1H3,(H3,19,20)(H,22,23)