methyl 4-[[2-methoxy-5-(4-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-methoxy-5-(4-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-methoxy-5-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]amino]benzoate CAS Name: 4-[[[2-methoxy-5-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-methoxy-5-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]benzoate Traditional Name: 4-[[2-methoxy-5-(4-methylpiperidino)sulfonyl-benzoyl]amino]benzoic acid methyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H26N2O6S/c1-15-10-12-24(13-11-15)31(27,28)18-8-9-20(29-2)19(14-18)21(25)23-17-6-4-16(5-7-17)22(26)30-3/h4-9,14-15H,10-13H2,1-3H3,(H,23,25)