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2-[4-[(5,7-diethyl-2-hexyl-6-oxidanylidene-cyclohepta[d]imidazol-3-yl)methyl]phenyl]benzoic acid

2-[4-[(5,7-diethyl-2-hexyl-6-oxidanylidene-cyclohepta[d]imidazol-3-yl)methyl]phenyl]benzoic acid

Systemtic Name:2-[4-[(5,7-diethyl-2-hexyl-6-oxidanylidene-cyclohepta[d]imidazol-3-yl)methyl]phenyl]benzoic acid
Openeye Name:2-[4-[(5,7-diethyl-2-hexyl-6-oxo-cyclohepta[d]imidazol-3-yl)methyl]phenyl]benzoic acid
CAS Name:2-[4-[(5,7-diethyl-2-hexyl-6-oxo-3-cyclohepta[d]imidazolyl)methyl]phenyl]benzoic acid
IUPAC Name:2-[4-[(5,7-diethyl-2-hexyl-6-oxocyclohepta[d]imidazol-3-yl)methyl]phenyl]benzoic acid
Traditional Name:2-[4-[(5,7-diethyl-2-hexyl-6-keto-cyclohept[d]imidazol-3-yl)methyl]phenyl]benzoic acid
Formula: C32H36N2O3
MolecularWeight: 496.63984
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=C(C(=O)C(=C2)CC)CC


Isomeric SMILES

CCCCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=C(C(=O)C(=C2)CC)CC


InChI

InChI=1S/C32H36N2O3/c1-4-7-8-9-14-30-33-28-19-23(5-2)31(35)24(6-3)20-29(28)34(30)21-22-15-17-25(18-16-22)26-12-10-11-13-27(26)32(36)37/h10-13,15-20H,4-9,14,21H2,1-3H3,(H,36,37)


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