methyl 2-[2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[4-(1-piperidylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-piperidin-1-ylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(4-piperidinosulfonylanilino)acetyl]amino]benzoic acid methyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25N3O5S/c1-29-21(26)18-7-3-4-8-19(18)23-20(25)15-22-16-9-11-17(12-10-16)30(27,28)24-13-5-2-6-14-24/h3-4,7-12,22H,2,5-6,13-15H2,1H3,(H,23,25)