sulfamoyl 2-[(7-carbamimidoylnaphthalen-2-yl)methyl-ethoxycarbonyl-amino]ethanoate dihydrochloride

Systemtic Name: sulfamoyl 2-[(7-carbamimidoylnaphthalen-2-yl)methyl-ethoxycarbonyl-amino]ethanoate dihydrochloride Openeye Name: sulfamoyl 2-[(7-carbamimidoyl-2-naphthyl)methyl-ethoxycarbonyl-amino]acetate dihydrochloride CAS Name: 2-[(7-carbamimidoyl-2-naphthalenyl)methyl-ethoxycarbonylamino]acetic acid sulfamoyl ester dihydrochloride IUPAC Name: sulfamoyl 2-[(7-carbamimidoylnaphthalen-2-yl)methyl-ethoxycarbonylamino]acetate dihydrochloride Traditional Name: 2-[(7-amidino-2-naphthyl)methyl-carbethoxy-amino]acetic acid sulfamoyl ester dihydrochloride Formula: C17H22Cl2N4O6S MolecularWeight: 481.35078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CC1=CC2=C(C=C1)C=CC(=C2)C(=N)N)CC(=O)OS(=O)(=O)N.Cl.Cl

Isomeric SMILES

CCOC(=O)N(CC1=CC2=C(C=C1)C=CC(=C2)C(=N)N)CC(=O)OS(=O)(=O)N.Cl.Cl

InChI

InChI=1S/C17H20N4O6S.2ClH/c1-2-26-17(23)21(10-15(22)27-28(20,24)25)9-11-3-4-12-5-6-13(16(18)19)8-14(12)7-11;;/h3-8H,2,9-10H2,1H3,(H3,18,19)(H2,20,24,25);2*1H