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

Systemtic Name: butyl 4-[[2-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]benzoate Openeye Name: butyl 4-[[2-methyl-5-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]amino]benzoate CAS Name: 4-[[[2-methyl-5-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-methyl-5-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]benzoate Traditional Name: 4-[[2-methyl-5-(4-methylpiperidino)sulfonyl-benzoyl]amino]benzoic acid butyl ester Formula: C25H32N2O5S MolecularWeight: 472.59698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)C

InChI

InChI=1S/C25H32N2O5S/c1-4-5-16-32-25(29)20-7-9-21(10-8-20)26-24(28)23-17-22(11-6-19(23)3)33(30,31)27-14-12-18(2)13-15-27/h6-11,17-18H,4-5,12-16H2,1-3H3,(H,26,28)