2-[[4-[2-[(4-piperidin-1-ylphenyl)carbonylamino]ethoxy]phenyl]methyl]hexanoate

Systemtic Name: 2-[[4-[2-[(4-piperidin-1-ylphenyl)carbonylamino]ethoxy]phenyl]methyl]hexanoate Openeye Name: 2-[[4-[2-[[4-(1-piperidyl)benzoyl]amino]ethoxy]phenyl]methyl]hexanoate CAS Name: 2-[[4-[2-[[oxo-[4-(1-piperidinyl)phenyl]methyl]amino]ethoxy]phenyl]methyl]hexanoate IUPAC Name: 2-[[4-[2-[(4-piperidin-1-ylbenzoyl)amino]ethoxy]phenyl]methyl]hexanoate Traditional Name: 2-[4-[2-[(4-piperidinobenzoyl)amino]ethoxy]benzyl]hexanoate Formula: C27H35N2O4- MolecularWeight: 451.5778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=C(C=C1)OCCNC(=O)C2=CC=C(C=C2)N3CCCCC3)C(=O)[O-]

Isomeric SMILES

CCCCC(CC1=CC=C(C=C1)OCCNC(=O)C2=CC=C(C=C2)N3CCCCC3)C(=O)[O-]

InChI

InChI=1S/C27H36N2O4/c1-2-3-7-23(27(31)32)20-21-8-14-25(15-9-21)33-19-16-28-26(30)22-10-12-24(13-11-22)29-17-5-4-6-18-29/h8-15,23H,2-7,16-20H2,1H3,(H,28,30)(H,31,32)/p-1