methyl 2-(2-azanyl-3-sulfamoyl-phenyl)carbonylpentanoate

Systemtic Name: methyl 2-(2-azanyl-3-sulfamoyl-phenyl)carbonylpentanoate Openeye Name: methyl 2-(2-amino-3-sulfamoyl-benzoyl)pentanoate CAS Name: 2-[(2-amino-3-sulfamoylphenyl)-oxomethyl]pentanoic acid methyl ester IUPAC Name: methyl 2-(2-amino-3-sulfamoylbenzoyl)pentanoate Traditional Name: 2-(2-amino-3-sulfamoyl-benzoyl)valeric acid methyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=C(C(=CC=C1)S(=O)(=O)N)N)C(=O)OC

Isomeric SMILES

CCCC(C(=O)C1=C(C(=CC=C1)S(=O)(=O)N)N)C(=O)OC

InChI

InChI=1S/C13H18N2O5S/c1-3-5-9(13(17)20-2)12(16)8-6-4-7-10(11(8)14)21(15,18)19/h4,6-7,9H,3,5,14H2,1-2H3,(H2,15,18,19)