methyl 3-[5-[(E)-3-oxidanylidene-3-(4-phenylpiperazin-1-yl)prop-1-enyl]furan-2-yl]propanoate

Systemtic Name: methyl 3-[5-[(E)-3-oxidanylidene-3-(4-phenylpiperazin-1-yl)prop-1-enyl]furan-2-yl]propanoate Openeye Name: methyl 3-[5-[(E)-3-oxo-3-(4-phenylpiperazin-1-yl)prop-1-enyl]-2-furyl]propanoate CAS Name: 3-[5-[(E)-3-oxo-3-(4-phenyl-1-piperazinyl)prop-1-enyl]-2-furanyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[(E)-3-oxo-3-(4-phenylpiperazin-1-yl)prop-1-enyl]furan-2-yl]propanoate Traditional Name: 3-[5-[(E)-3-keto-3-(4-phenylpiperazino)prop-1-enyl]-2-furyl]propionic acid methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(O1)C=CC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCC1=CC=C(O1)/C=C/C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O4/c1-26-21(25)12-10-19-8-7-18(27-19)9-11-20(24)23-15-13-22(14-16-23)17-5-3-2-4-6-17/h2-9,11H,10,12-16H2,1H3/b11-9+