1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazin-1-yl]-3-(2-oxidanylphenoxy)propan-1-one

Systemtic Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazin-1-yl]-3-(2-oxidanylphenoxy)propan-1-one Openeye Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazin-1-yl]-3-(2-hydroxyphenoxy)propan-1-one CAS Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]-1-piperazinyl]-3-(2-hydroxyphenoxy)-1-propanone IUPAC Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazin-1-yl]-3-(2-hydroxyphenoxy)propan-1-one Traditional Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazino]-3-(2-hydroxyphenoxy)propan-1-one Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3O)C

InChI

InChI=1S/C23H30N2O3/c1-17-8-9-20(16-18(17)2)19(3)24-11-13-25(14-12-24)23(27)10-15-28-22-7-5-4-6-21(22)26/h4-9,16,19,26H,10-15H2,1-3H3