[1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] 3-methylsulfonylbenzoate

Systemtic Name: [1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] 3-methylsulfonylbenzoate Openeye Name: [1-methyl-2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [1-oxo-1-[4-(1-piperidinyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-piperidin-1-ylanilino)propan-2-yl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-1-methyl-2-(4-piperidinoanilino)ethyl] ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)OC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)OC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H26N2O5S/c1-16(29-22(26)17-7-6-8-20(15-17)30(2,27)28)21(25)23-18-9-11-19(12-10-18)24-13-4-3-5-14-24/h6-12,15-16H,3-5,13-14H2,1-2H3,(H,23,25)