[4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-cyclopropyl-methanone

Systemtic Name: [4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-cyclopropyl-methanone Openeye Name: [4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]piperazin-1-yl]-cyclopropyl-methanone CAS Name: [4-[3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-cyclopropylmethanone IUPAC Name: [4-[3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-cyclopropylmethanone Traditional Name: [4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]piperazino]-cyclopropyl-methanone Formula: C22H34N2O3 MolecularWeight: 374.51696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OCC(CN2CCN(CC2)C(=O)C3CC3)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OCC(CN2CCN(CC2)C(=O)C3CC3)O

InChI

InChI=1S/C22H34N2O3/c1-16-13-18(22(2,3)4)7-8-20(16)27-15-19(25)14-23-9-11-24(12-10-23)21(26)17-5-6-17/h7-8,13,17,19,25H,5-6,9-12,14-15H2,1-4H3