3-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenyl]butanoic acid

Systemtic Name: 3-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenyl]butanoic acid Openeye Name: 3-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenyl]butanoic acid CAS Name: 3-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenyl]butanoic acid IUPAC Name: 3-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]ethyl]phenyl]butanoic acid Traditional Name: 3-[4-[2-[(4-amidinophenyl)sulfonylamino]ethyl]phenyl]butyric acid Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O4S/c1-13(12-18(23)24)15-4-2-14(3-5-15)10-11-22-27(25,26)17-8-6-16(7-9-17)19(20)21/h2-9,13,22H,10-12H2,1H3,(H3,20,21)(H,23,24)