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4-[2-[(4-heptylphenyl)carbonylamino]phenoxy]phthalic acid

4-[2-[(4-heptylphenyl)carbonylamino]phenoxy]phthalic acid

Systemtic Name:4-[2-[(4-heptylphenyl)carbonylamino]phenoxy]phthalic acid
Openeye Name:4-[2-[(4-heptylbenzoyl)amino]phenoxy]phthalic acid
CAS Name:4-[2-[[(4-heptylphenyl)-oxomethyl]amino]phenoxy]phthalic acid
IUPAC Name:4-[2-[(4-heptylbenzoyl)amino]phenoxy]phthalic acid
Traditional Name:4-[2-[(4-heptylbenzoyl)amino]phenoxy]phthalic acid
Formula: C28H29NO6
MolecularWeight: 475.53296
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2OC3=CC(=C(C=C3)C(=O)O)C(=O)O


Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2OC3=CC(=C(C=C3)C(=O)O)C(=O)O


InChI

InChI=1S/C28H29NO6/c1-2-3-4-5-6-9-19-12-14-20(15-13-19)26(30)29-24-10-7-8-11-25(24)35-21-16-17-22(27(31)32)23(18-21)28(33)34/h7-8,10-18H,2-6,9H2,1H3,(H,29,30)(H,31,32)(H,33,34)


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