2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-[(4-amidinophenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propionic acid Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H23N3O5S/c1-19(2,18(23)24)27-15-7-3-13(4-8-15)11-12-22-28(25,26)16-9-5-14(6-10-16)17(20)21/h3-10,22H,11-12H2,1-2H3,(H3,20,21)(H,23,24)