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

Systemtic Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazin-1-yl]-3-(3-oxidanylphenoxy)propan-1-one Openeye Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazin-1-yl]-3-(3-hydroxyphenoxy)propan-1-one CAS Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]-1-piperazinyl]-3-(3-hydroxyphenoxy)-1-propanone IUPAC Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazin-1-yl]-3-(3-hydroxyphenoxy)propan-1-one Traditional Name: 1-[4-[1-(3,4-dimethylphenyl)ethyl]piperazino]-3-(3-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(=C3)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)N2CCN(CC2)C(=O)CCOC3=CC=CC(=C3)O)C

InChI

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