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5-[4-[octan-4-yl(phenylcarbonyl)amino]phenyl]pentanoic acid

5-[4-[octan-4-yl(phenylcarbonyl)amino]phenyl]pentanoic acid

Systemtic Name:5-[4-[octan-4-yl(phenylcarbonyl)amino]phenyl]pentanoic acid
Openeye Name:5-[4-[benzoyl(1-propylpentyl)amino]phenyl]pentanoic acid
CAS Name:5-[4-[benzoyl(octan-4-yl)amino]phenyl]pentanoic acid
IUPAC Name:5-[4-[benzoyl(octan-4-yl)amino]phenyl]pentanoic acid
Traditional Name:5-[4-[benzoyl(1-propylpentyl)amino]phenyl]valeric acid
Formula: C26H35NO3
MolecularWeight: 409.561
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)N(C1=CC=C(C=C1)CCCCC(=O)O)C(=O)C2=CC=CC=C2


Isomeric SMILES

CCCCC(CCC)N(C1=CC=C(C=C1)CCCCC(=O)O)C(=O)C2=CC=CC=C2


InChI

InChI=1S/C26H35NO3/c1-3-5-15-23(11-4-2)27(26(30)22-13-7-6-8-14-22)24-19-17-21(18-20-24)12-9-10-16-25(28)29/h6-8,13-14,17-20,23H,3-5,9-12,15-16H2,1-2H3,(H,28,29)


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