[2-(4-tert-butylphenoxy)pyridin-3-yl]-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(4-tert-butylphenoxy)pyridin-3-yl]-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methanone Openeye Name: [2-(4-tert-butylphenoxy)-3-pyridyl]-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]methanone CAS Name: [2-(4-tert-butylphenoxy)-3-pyridinyl]-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(4-tert-butylphenoxy)pyridin-3-yl]-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone Traditional Name: [2-(4-tert-butylphenoxy)-3-pyridyl]-[4-(5-chloro-2-methyl-phenyl)piperazino]methanone Formula: C27H30ClN3O2 MolecularWeight: 463.999

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H30ClN3O2/c1-19-7-10-21(28)18-24(19)30-14-16-31(17-15-30)26(32)23-6-5-13-29-25(23)33-22-11-8-20(9-12-22)27(2,3)4/h5-13,18H,14-17H2,1-4H3