methyl 1-[4-[(4-propan-2-ylphenyl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate

Systemtic Name: methyl 1-[4-[(4-propan-2-ylphenyl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate Openeye Name: methyl 1-[4-[(4-isopropylbenzoyl)amino]phenyl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[4-[[oxo-(4-propan-2-ylphenyl)methyl]amino]phenyl]sulfonyl-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(4-propan-2-ylbenzoyl)amino]phenyl]sulfonylpiperidine-3-carboxylate Traditional Name: 1-[4-(cumoylamino)phenyl]sulfonylnipecotic acid methyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC

InChI

InChI=1S/C23H28N2O5S/c1-16(2)17-6-8-18(9-7-17)22(26)24-20-10-12-21(13-11-20)31(28,29)25-14-4-5-19(15-25)23(27)30-3/h6-13,16,19H,4-5,14-15H2,1-3H3,(H,24,26)