1-[4-[3-(4-bromanyl-2-methyl-phenoxy)propanoyl]piperazin-1-yl]-3-(4-oxidanylphenoxy)propan-1-one

Systemtic Name: 1-[4-[3-(4-bromanyl-2-methyl-phenoxy)propanoyl]piperazin-1-yl]-3-(4-oxidanylphenoxy)propan-1-one Openeye Name: 1-[4-[3-(4-bromo-2-methyl-phenoxy)propanoyl]piperazin-1-yl]-3-(4-hydroxyphenoxy)propan-1-one CAS Name: 1-[4-[3-(4-bromo-2-methylphenoxy)-1-oxopropyl]-1-piperazinyl]-3-(4-hydroxyphenoxy)-1-propanone IUPAC Name: 1-[4-[3-(4-bromo-2-methylphenoxy)propanoyl]piperazin-1-yl]-3-(4-hydroxyphenoxy)propan-1-one Traditional Name: 1-[4-[3-(4-bromo-2-methyl-phenoxy)propanoyl]piperazino]-3-(4-hydroxyphenoxy)propan-1-one Formula: C23H27BrN2O5 MolecularWeight: 491.37488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27BrN2O5/c1-17-16-18(24)2-7-21(17)31-15-9-23(29)26-12-10-25(11-13-26)22(28)8-14-30-20-5-3-19(27)4-6-20/h2-7,16,27H,8-15H2,1H3