ethyl 4-[1-azanyl-1-oxidanylidene-3-(5-oxidanyl-2-piperidin-1-yl-phenyl)hexan-2-yl]benzoate

Systemtic Name: ethyl 4-[1-azanyl-1-oxidanylidene-3-(5-oxidanyl-2-piperidin-1-yl-phenyl)hexan-2-yl]benzoate Openeye Name: ethyl 4-[1-carbamoyl-2-[5-hydroxy-2-(1-piperidyl)phenyl]pentyl]benzoate CAS Name: 4-[1-amino-3-[5-hydroxy-2-(1-piperidinyl)phenyl]-1-oxohexan-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-amino-3-(5-hydroxy-2-piperidin-1-ylphenyl)-1-oxohexan-2-yl]benzoate Traditional Name: 4-[1-carbamoyl-2-(5-hydroxy-2-piperidino-phenyl)pentyl]benzoic acid ethyl ester Formula: C26H34N2O4 MolecularWeight: 438.55916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=CC(=C1)O)N2CCCCC2)C(C3=CC=C(C=C3)C(=O)OCC)C(=O)N

Isomeric SMILES

CCCC(C1=C(C=CC(=C1)O)N2CCCCC2)C(C3=CC=C(C=C3)C(=O)OCC)C(=O)N

InChI

InChI=1S/C26H34N2O4/c1-3-8-21(22-17-20(29)13-14-23(22)28-15-6-5-7-16-28)24(25(27)30)18-9-11-19(12-10-18)26(31)32-4-2/h9-14,17,21,24,29H,3-8,15-16H2,1-2H3,(H2,27,30)