4-[2-[[3-methyl-1-(2-piperidin-1-ylphenyl)butyl]amino]-2-oxidanylidene-ethyl]-2-oxidanyl-benzoate

Systemtic Name: 4-[2-[[3-methyl-1-(2-piperidin-1-ylphenyl)butyl]amino]-2-oxidanylidene-ethyl]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-4-[2-[[3-methyl-1-[2-(1-piperidyl)phenyl]butyl]amino]-2-oxo-ethyl]benzoate CAS Name: 2-hydroxy-4-[2-[[3-methyl-1-[2-(1-piperidinyl)phenyl]butyl]amino]-2-oxoethyl]benzoate IUPAC Name: 2-hydroxy-4-[2-[[3-methyl-1-(2-piperidin-1-ylphenyl)butyl]amino]-2-oxoethyl]benzoate Traditional Name: 2-hydroxy-4-[2-keto-2-[[3-methyl-1-(2-piperidinophenyl)butyl]amino]ethyl]benzoate Formula: C25H31N2O4- MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)[O-])O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)[O-])O

InChI

InChI=1S/C25H32N2O4/c1-17(2)14-21(19-8-4-5-9-22(19)27-12-6-3-7-13-27)26-24(29)16-18-10-11-20(25(30)31)23(28)15-18/h4-5,8-11,15,17,21,28H,3,6-7,12-14,16H2,1-2H3,(H,26,29)(H,30,31)/p-1