methyl 2-[4-[3-[(4-carbamimidoylphenyl)sulfonylamino]propyl]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[3-[(4-carbamimidoylphenyl)sulfonylamino]propyl]phenyl]ethanoate Openeye Name: methyl 2-[4-[3-[(4-carbamimidoylphenyl)sulfonylamino]propyl]phenyl]acetate CAS Name: 2-[4-[3-[(4-carbamimidoylphenyl)sulfonylamino]propyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[3-[(4-carbamimidoylphenyl)sulfonylamino]propyl]phenyl]acetate Traditional Name: 2-[4-[3-[(4-amidinophenyl)sulfonylamino]propyl]phenyl]acetic acid methyl ester Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)CCCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)CCCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H23N3O4S/c1-26-18(23)13-15-6-4-14(5-7-15)3-2-12-22-27(24,25)17-10-8-16(9-11-17)19(20)21/h4-11,22H,2-3,12-13H2,1H3,(H3,20,21)