methyl 4-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)amino]benzoate

Systemtic Name: methyl 4-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)amino]benzoate Openeye Name: methyl 4-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]amino]benzoate CAS Name: 4-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)amino]benzoate Traditional Name: 4-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)amino]benzoic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H21N3O5S/c1-27-19(24)14-5-7-15(8-6-14)21-20-22-17-13-16(9-10-18(17)28-20)29(25,26)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H,21,22)