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3-[3-(carboxymethyl)-4-tetradecoxy-phenyl]carbonylbenzoic acid

3-[3-(carboxymethyl)-4-tetradecoxy-phenyl]carbonylbenzoic acid

Systemtic Name:3-[3-(carboxymethyl)-4-tetradecoxy-phenyl]carbonylbenzoic acid
Openeye Name:3-[3-(carboxymethyl)-4-tetradecoxy-benzoyl]benzoic acid
CAS Name:3-[[3-(carboxymethyl)-4-tetradecoxyphenyl]-oxomethyl]benzoic acid
IUPAC Name:3-[3-(carboxymethyl)-4-tetradecoxybenzoyl]benzoic acid
Traditional Name:3-[3-(carboxymethyl)-4-myristyloxy-benzoyl]benzoic acid
Formula: C30H40O6
MolecularWeight: 496.635
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)CC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)CC(=O)O


InChI

InChI=1S/C30H40O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-36-27-18-17-24(21-26(27)22-28(31)32)29(33)23-15-14-16-25(20-23)30(34)35/h14-18,20-21H,2-13,19,22H2,1H3,(H,31,32)(H,34,35)


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