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methyl 2-[3-[8-(butylamino)-8-oxidanylidene-octyl]phenoxy]ethanoate

methyl 2-[3-[8-(butylamino)-8-oxidanylidene-octyl]phenoxy]ethanoate

Systemtic Name:methyl 2-[3-[8-(butylamino)-8-oxidanylidene-octyl]phenoxy]ethanoate
Openeye Name:methyl 2-[3-[8-(butylamino)-8-oxo-octyl]phenoxy]acetate
CAS Name:2-[3-[8-(butylamino)-8-oxooctyl]phenoxy]acetic acid methyl ester
IUPAC Name:methyl 2-[3-[8-(butylamino)-8-oxooctyl]phenoxy]acetate
Traditional Name:2-[3-[8-(butylamino)-8-keto-octyl]phenoxy]acetic acid methyl ester
Formula: C21H33NO4
MolecularWeight: 363.49102
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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCCCCCCC1=CC(=CC=C1)OCC(=O)OC


Isomeric SMILES

CCCCNC(=O)CCCCCCCC1=CC(=CC=C1)OCC(=O)OC


InChI

InChI=1S/C21H33NO4/c1-3-4-15-22-20(23)14-9-7-5-6-8-11-18-12-10-13-19(16-18)26-17-21(24)25-2/h10,12-13,16H,3-9,11,14-15,17H2,1-2H3,(H,22,23)


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