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1,3-dioctoxypropan-2-yl 3-azanyl-4-chloranyl-benzoate

1,3-dioctoxypropan-2-yl 3-azanyl-4-chloranyl-benzoate

Systemtic Name:1,3-dioctoxypropan-2-yl 3-azanyl-4-chloranyl-benzoate
Openeye Name:[2-octoxy-1-(octoxymethyl)ethyl] 3-amino-4-chloro-benzoate
CAS Name:3-amino-4-chlorobenzoic acid 1,3-dioctoxypropan-2-yl ester
IUPAC Name:1,3-dioctoxypropan-2-yl 3-amino-4-chlorobenzoate
Traditional Name:3-amino-4-chloro-benzoic acid [2-octoxy-1-(octoxymethyl)ethyl] ester
Formula: C26H44ClNO4
MolecularWeight: 470.08486
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(COCCCCCCCC)OC(=O)C1=CC(=C(C=C1)Cl)N


Isomeric SMILES

CCCCCCCCOCC(COCCCCCCCC)OC(=O)C1=CC(=C(C=C1)Cl)N


InChI

InChI=1S/C26H44ClNO4/c1-3-5-7-9-11-13-17-30-20-23(21-31-18-14-12-10-8-6-4-2)32-26(29)22-15-16-24(27)25(28)19-22/h15-16,19,23H,3-14,17-18,20-21,28H2,1-2H3


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