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N,N-diethyl-2-[4-[(E)-1-(4-methoxyphenyl)-2-phenyl-ethenyl]phenoxy]ethanamine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

N,N-diethyl-2-[4-[(E)-1-(4-methoxyphenyl)-2-phenyl-ethenyl]phenoxy]ethanamine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name:N,N-diethyl-2-[4-[(E)-1-(4-methoxyphenyl)-2-phenyl-ethenyl]phenoxy]ethanamine; 2-oxidanylpropane-1,2,3-tricarboxylic acid
Openeye Name:citric acid; N,N-diethyl-2-[4-[(E)-1-(4-methoxyphenyl)-2-phenyl-vinyl]phenoxy]ethanamine
CAS Name:N,N-diethyl-2-[4-[(E)-1-(4-methoxyphenyl)-2-phenylethenyl]phenoxy]ethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid
IUPAC Name:N,N-diethyl-2-[4-[(E)-1-(4-methoxyphenyl)-2-phenylethenyl]phenoxy]ethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid
Traditional Name:citric acid; diethyl-[2-[4-[(E)-1-(4-methoxyphenyl)-2-phenyl-vinyl]phenoxy]ethyl]amine
Formula: C33H39NO9
MolecularWeight: 593.66406
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)C(=CC2=CC=CC=C2)C3=CC=C(C=C3)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O


Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)/C(=C/C2=CC=CC=C2)/C3=CC=C(C=C3)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O


InChI

InChI=1S/C27H31NO2.C6H8O7/c1-4-28(5-2)19-20-30-26-17-13-24(14-18-26)27(21-22-9-7-6-8-10-22)23-11-15-25(29-3)16-12-23;7-3(8)1-6(13,5(11)12)2-4(9)10/h6-18,21H,4-5,19-20H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b27-21+;


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