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(Z)-3-[4-(2-bromanylphenoxy)phenyl]-2-(hexanoylamino)prop-2-enoic acid

(Z)-3-[4-(2-bromanylphenoxy)phenyl]-2-(hexanoylamino)prop-2-enoic acid

Systemtic Name:(Z)-3-[4-(2-bromanylphenoxy)phenyl]-2-(hexanoylamino)prop-2-enoic acid
Openeye Name:(Z)-3-[4-(2-bromophenoxy)phenyl]-2-(hexanoylamino)prop-2-enoic acid
CAS Name:(Z)-3-[4-(2-bromophenoxy)phenyl]-2-(1-oxohexylamino)-2-propenoic acid
IUPAC Name:(Z)-3-[4-(2-bromophenoxy)phenyl]-2-(hexanoylamino)prop-2-enoic acid
Traditional Name:(Z)-3-[4-(2-bromophenoxy)phenyl]-2-(caproylamino)acrylic acid
Formula: C21H22BrNO4
MolecularWeight: 432.30768
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=CC1=CC=C(C=C1)OC2=CC=CC=C2Br)C(=O)O


Isomeric SMILES

CCCCCC(=O)N/C(=C\C1=CC=C(C=C1)OC2=CC=CC=C2Br)/C(=O)O


InChI

InChI=1S/C21H22BrNO4/c1-2-3-4-9-20(24)23-18(21(25)26)14-15-10-12-16(13-11-15)27-19-8-6-5-7-17(19)22/h5-8,10-14H,2-4,9H2,1H3,(H,23,24)(H,25,26)/b18-14-


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