(E)-1-(4-ethanoylpiperazin-1-yl)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-ethanoylpiperazin-1-yl)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-acetyl-1-piperazinyl)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-acetylpiperazino)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-en-1-one Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)N2CCN(CC2)C(=O)C)OCCOC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)N2CCN(CC2)C(=O)C)OCCOC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O5/c1-3-30-24-19-21(10-12-25(29)27-15-13-26(14-16-27)20(2)28)9-11-23(24)32-18-17-31-22-7-5-4-6-8-22/h4-12,19H,3,13-18H2,1-2H3/b12-10+