(2S)-2-(4-tert-butylphenoxy)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: (2S)-2-(4-tert-butylphenoxy)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]propan-1-one Openeye Name: (2S)-2-(4-tert-butylphenoxy)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]propan-1-one CAS Name: (2S)-2-(4-tert-butylphenoxy)-1-[4-(2-ethoxyphenyl)-1-piperazinyl]-1-propanone IUPAC Name: (2S)-2-(4-tert-butylphenoxy)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]propan-1-one Traditional Name: (2S)-2-(4-tert-butylphenoxy)-1-(4-o-phenetylpiperazino)propan-1-one Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C(C)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)[C@H](C)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H34N2O3/c1-6-29-23-10-8-7-9-22(23)26-15-17-27(18-16-26)24(28)19(2)30-21-13-11-20(12-14-21)25(3,4)5/h7-14,19H,6,15-18H2,1-5H3/t19-/m0/s1