4-[3-(5-acetyloxy-2-piperidin-1-yl-phenyl)-1-azanyl-1-oxidanylidene-butan-2-yl]benzoic acid

Systemtic Name: 4-[3-(5-acetyloxy-2-piperidin-1-yl-phenyl)-1-azanyl-1-oxidanylidene-butan-2-yl]benzoic acid Openeye Name: 4-[2-[5-acetoxy-2-(1-piperidyl)phenyl]-1-carbamoyl-propyl]benzoic acid CAS Name: 4-[3-[5-acetyloxy-2-(1-piperidinyl)phenyl]-1-amino-1-oxobutan-2-yl]benzoic acid IUPAC Name: 4-[3-(5-acetyloxy-2-piperidin-1-ylphenyl)-1-amino-1-oxobutan-2-yl]benzoic acid Traditional Name: 4-[2-(5-acetoxy-2-piperidino-phenyl)-1-carbamoyl-propyl]benzoic acid Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC(=O)C)N2CCCCC2)C(C3=CC=C(C=C3)C(=O)O)C(=O)N

Isomeric SMILES

CC(C1=C(C=CC(=C1)OC(=O)C)N2CCCCC2)C(C3=CC=C(C=C3)C(=O)O)C(=O)N

InChI

InChI=1S/C24H28N2O5/c1-15(22(23(25)28)17-6-8-18(9-7-17)24(29)30)20-14-19(31-16(2)27)10-11-21(20)26-12-4-3-5-13-26/h6-11,14-15,22H,3-5,12-13H2,1-2H3,(H2,25,28)(H,29,30)