methyl 4-[2-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[3-(1-piperidylsulfonyl)benzoyl]amino]ethyl]benzoate CAS Name: 4-[2-[[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]ethyl]benzoate Traditional Name: 4-[2-[(3-piperidinosulfonylbenzoyl)amino]ethyl]benzoic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H26N2O5S/c1-29-22(26)18-10-8-17(9-11-18)12-13-23-21(25)19-6-5-7-20(16-19)30(27,28)24-14-3-2-4-15-24/h5-11,16H,2-4,12-15H2,1H3,(H,23,25)