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O2-[(5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)methyl] O1-ethyl ethanedioate; 4-(2-phenethylphenyl)piperidine

O2-[(5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)methyl] O1-ethyl ethanedioate; 4-(2-phenethylphenyl)piperidine

Systemtic Name:O2-[(5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)methyl] O1-ethyl ethanedioate; 4-(2-phenethylphenyl)piperidine
Openeye Name:O2-[(5-chloro-2-oxo-1H-pyridin-3-yl)methyl] O1-ethyl oxalate; 4-(2-phenethylphenyl)piperidine
CAS Name:oxalic acid O2-[(5-chloro-2-oxo-1H-pyridin-3-yl)methyl] ester O1-ethyl ester; 4-(2-phenethylphenyl)piperidine
IUPAC Name:2-O-[(5-chloro-2-oxo-1H-pyridin-3-yl)methyl] 1-O-ethyl oxalate; 4-(2-phenethylphenyl)piperidine
Traditional Name:oxalic acid O2-[(5-chloro-2-keto-1H-pyridin-3-yl)methyl] ester O1-ethyl ester; 4-(2-phenethylphenyl)piperidine
Formula: C29H33ClN2O5
MolecularWeight: 525.03572
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)OCC1=CC(=CNC1=O)Cl.C1CNCCC1C2=CC=CC=C2CCC3=CC=CC=C3


Isomeric SMILES

CCOC(=O)C(=O)OCC1=CC(=CNC1=O)Cl.C1CNCCC1C2=CC=CC=C2CCC3=CC=CC=C3


InChI

InChI=1S/C19H23N.C10H10ClNO5/c1-2-6-16(7-3-1)10-11-17-8-4-5-9-19(17)18-12-14-20-15-13-18;1-2-16-9(14)10(15)17-5-6-3-7(11)4-12-8(6)13/h1-9,18,20H,10-15H2;3-4H,2,5H2,1H3,(H,12,13)


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