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

Systemtic Name: 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl 2-phenoxyethanoate Openeye Name: 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl ester IUPAC Name: 2-[(4-carbamimidoylphenyl)sulfonylamino]propyl 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid 2-[(4-amidinophenyl)sulfonylamino]propyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)COC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(COC(=O)COC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H21N3O5S/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/h2-10,13,21H,11-12H2,1H3,(H3,19,20)