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2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate; iodanylethane

2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate; iodanylethane

Systemtic Name:2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate; iodanylethane
Openeye Name:2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate; iodoethane
CAS Name:3-[4-[6-(diethylamino)hexyl]phenyl]propanoic acid 2-diethylaminoethyl ester; iodoethane
IUPAC Name:2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate; iodoethane
Traditional Name:3-[4-[6-(diethylamino)hexyl]phenyl]propionic acid 2-diethylaminoethyl ester; iodoethane
Formula: C29H54I2N2O2
MolecularWeight: 716.5602
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCCCC1=CC=C(C=C1)CCC(=O)OCCN(CC)CC.CCI.CCI


Isomeric SMILES

CCN(CC)CCCCCCC1=CC=C(C=C1)CCC(=O)OCCN(CC)CC.CCI.CCI


InChI

InChI=1S/C25H44N2O2.2C2H5I/c1-5-26(6-2)20-12-10-9-11-13-23-14-16-24(17-15-23)18-19-25(28)29-22-21-27(7-3)8-4;2*1-2-3/h14-17H,5-13,18-22H2,1-4H3;2*2H2,1H3


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