methyl 4-[2-(naphthalen-2-ylsulfonylamino)propanoylamino]benzoate

Systemtic Name: methyl 4-[2-(naphthalen-2-ylsulfonylamino)propanoylamino]benzoate Openeye Name: methyl 4-[2-(2-naphthylsulfonylamino)propanoylamino]benzoate CAS Name: 4-[[2-(2-naphthalenylsulfonylamino)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(naphthalen-2-ylsulfonylamino)propanoylamino]benzoate Traditional Name: 4-[2-(2-naphthylsulfonylamino)propanoylamino]benzoic acid methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H20N2O5S/c1-14(20(24)22-18-10-7-16(8-11-18)21(25)28-2)23-29(26,27)19-12-9-15-5-3-4-6-17(15)13-19/h3-14,23H,1-2H3,(H,22,24)