8-[4-(4-dimethylaminophenyl)-3-(1H-imidazol-2-yl)-2-methoxy-5-methyl-phenyl]octanoate

Systemtic Name: 8-[4-(4-dimethylaminophenyl)-3-(1H-imidazol-2-yl)-2-methoxy-5-methyl-phenyl]octanoate Openeye Name: 8-[4-(4-dimethylaminophenyl)-3-(1H-imidazol-2-yl)-2-methoxy-5-methyl-phenyl]octanoate CAS Name: 8-[4-(4-dimethylaminophenyl)-3-(1H-imidazol-2-yl)-2-methoxy-5-methylphenyl]octanoate IUPAC Name: 8-[4-(4-dimethylaminophenyl)-3-(1H-imidazol-2-yl)-2-methoxy-5-methylphenyl]octanoate Traditional Name: 8-[4-(4-dimethylaminophenyl)-3-(1H-imidazol-2-yl)-2-methoxy-5-methyl-phenyl]caprylate Formula: C27H34N3O3- MolecularWeight: 448.57716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C2=CC=C(C=C2)N(C)C)C3=NC=CN3)OC)CCCCCCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1C2=CC=C(C=C2)N(C)C)C3=NC=CN3)OC)CCCCCCCC(=O)[O-]

InChI

InChI=1S/C27H35N3O3/c1-19-18-21(10-8-6-5-7-9-11-23(31)32)26(33-4)25(27-28-16-17-29-27)24(19)20-12-14-22(15-13-20)30(2)3/h12-18H,5-11H2,1-4H3,(H,28,29)(H,31,32)/p-1