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

Systemtic Name: 3-(4-methyl-2-nitro-phenoxy)-1-[4-[3-(2-oxidanylphenoxy)propanoyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[3-(2-hydroxyphenoxy)propanoyl]piperazin-1-yl]-3-(4-methyl-2-nitro-phenoxy)propan-1-one CAS Name: 1-[4-[3-(2-hydroxyphenoxy)-1-oxopropyl]-1-piperazinyl]-3-(4-methyl-2-nitrophenoxy)-1-propanone IUPAC Name: 1-[4-[3-(2-hydroxyphenoxy)propanoyl]piperazin-1-yl]-3-(4-methyl-2-nitrophenoxy)propan-1-one Traditional Name: 1-[4-[3-(2-hydroxyphenoxy)propanoyl]piperazino]-3-(4-methyl-2-nitro-phenoxy)propan-1-one Formula: C23H27N3O7 MolecularWeight: 457.47638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3O)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O7/c1-17-6-7-20(18(16-17)26(30)31)32-14-8-22(28)24-10-12-25(13-11-24)23(29)9-15-33-21-5-3-2-4-19(21)27/h2-7,16,27H,8-15H2,1H3