2-(4-tert-butylphenoxy)-1-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-tert-butylphenoxy)-1-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-(4-tert-butylphenoxy)-1-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]propan-1-one CAS Name: 2-(4-tert-butylphenoxy)-1-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-tert-butylphenoxy)-1-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]propan-1-one Traditional Name: 2-(4-tert-butylphenoxy)-1-(4-veratroylpiperazino)propan-1-one Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)OC)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)OC)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H34N2O5/c1-18(33-21-10-8-20(9-11-21)26(2,3)4)24(29)27-13-15-28(16-14-27)25(30)19-7-12-22(31-5)23(17-19)32-6/h7-12,17-18H,13-16H2,1-6H3