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2-oxidanylpropyl (E)-3-[4-(hexadecylamino)phenyl]prop-2-enoate

2-oxidanylpropyl (E)-3-[4-(hexadecylamino)phenyl]prop-2-enoate

Systemtic Name:2-oxidanylpropyl (E)-3-[4-(hexadecylamino)phenyl]prop-2-enoate
Openeye Name:2-hydroxypropyl (E)-3-[4-(hexadecylamino)phenyl]prop-2-enoate
CAS Name:(E)-3-[4-(hexadecylamino)phenyl]-2-propenoic acid 2-hydroxypropyl ester
IUPAC Name:2-hydroxypropyl (E)-3-[4-(hexadecylamino)phenyl]prop-2-enoate
Traditional Name:(E)-3-[4-(cetylamino)phenyl]acrylic acid 2-hydroxypropyl ester
Formula: C28H47NO3
MolecularWeight: 445.67768
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C=CC(=O)OCC(C)O


Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)/C=C/C(=O)OCC(C)O


InChI

InChI=1S/C28H47NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-29-27-20-17-26(18-21-27)19-22-28(31)32-24-25(2)30/h17-22,25,29-30H,3-16,23-24H2,1-2H3/b22-19+


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