methyl 3-[[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]methyl]benzoate

Systemtic Name: methyl 3-[[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]methyl]benzoate Openeye Name: methyl 3-[[2-isopropoxy-5-(1-piperidylsulfonyl)anilino]methyl]benzoate CAS Name: 3-[[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyanilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyanilino)methyl]benzoate Traditional Name: 3-[(2-isopropoxy-5-piperidinosulfonyl-anilino)methyl]benzoic acid methyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C23H30N2O5S/c1-17(2)30-22-11-10-20(31(27,28)25-12-5-4-6-13-25)15-21(22)24-16-18-8-7-9-19(14-18)23(26)29-3/h7-11,14-15,17,24H,4-6,12-13,16H2,1-3H3