methyl 4-[(E)-3-[4-(4-ethanoylpiperazin-1-yl)phenoxy]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[4-(4-ethanoylpiperazin-1-yl)phenoxy]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[4-(4-acetylpiperazin-1-yl)phenoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[4-(4-acetyl-1-piperazinyl)phenoxy]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[4-(4-acetylpiperazin-1-yl)phenoxy]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[4-(4-acetylpiperazino)phenoxy]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC(=O)C=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC(=O)/C=C/C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H24N2O5/c1-17(26)24-13-15-25(16-14-24)20-8-10-21(11-9-20)30-22(27)12-5-18-3-6-19(7-4-18)23(28)29-2/h3-12H,13-16H2,1-2H3/b12-5+