ethyl 4-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-3-methyl-benzoate

Systemtic Name: ethyl 4-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-3-methyl-benzoate Openeye Name: ethyl 4-[[2-methoxy-5-(1-piperidylsulfonyl)benzoyl]amino]-3-methyl-benzoate CAS Name: 4-[[[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]-3-methylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-methoxy-5-piperidin-1-ylsulfonylbenzoyl)amino]-3-methylbenzoate Traditional Name: 4-[(2-methoxy-5-piperidinosulfonyl-benzoyl)amino]-3-methyl-benzoic acid ethyl ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O6S/c1-4-31-23(27)17-8-10-20(16(2)14-17)24-22(26)19-15-18(9-11-21(19)30-3)32(28,29)25-12-6-5-7-13-25/h8-11,14-15H,4-7,12-13H2,1-3H3,(H,24,26)