ethyl 3-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 3-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate Openeye Name: ethyl 3-[[2-methyl-5-(1-piperidylsulfonyl)benzoyl]amino]benzoate CAS Name: 3-[[[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-methyl-5-piperidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 3-[(2-methyl-5-piperidinosulfonyl-benzoyl)amino]benzoic acid ethyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C22H26N2O5S/c1-3-29-22(26)17-8-7-9-18(14-17)23-21(25)20-15-19(11-10-16(20)2)30(27,28)24-12-5-4-6-13-24/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,23,25)