[4-[3-(2,4-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-(4-ethylphenyl)methanone

Systemtic Name: [4-[3-(2,4-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-(4-ethylphenyl)methanone Openeye Name: [4-[3-(2,4-dimethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-(4-ethylphenyl)methanone CAS Name: [4-[3-(2,4-dimethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-(4-ethylphenyl)methanone IUPAC Name: [4-[3-(2,4-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-(4-ethylphenyl)methanone Traditional Name: [4-[3-(2,4-dimethylphenoxy)-2-hydroxy-propyl]piperazino]-(4-ethylphenyl)methanone Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C)C)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C)C)O

InChI

InChI=1S/C24H32N2O3/c1-4-20-6-8-21(9-7-20)24(28)26-13-11-25(12-14-26)16-22(27)17-29-23-10-5-18(2)15-19(23)3/h5-10,15,22,27H,4,11-14,16-17H2,1-3H3