methyl (E)-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)but-2-enoate

Systemtic Name: methyl (E)-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)but-2-enoate Openeye Name: methyl (E)-4-oxo-4-(4-phenylpiperazin-1-yl)but-2-enoate CAS Name: (E)-4-oxo-4-(4-phenyl-1-piperazinyl)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-oxo-4-(4-phenylpiperazin-1-yl)but-2-enoate Traditional Name: (E)-4-keto-4-(4-phenylpiperazino)but-2-enoic acid methyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)N1CCN(CC1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)/C=C/C(=O)N1CCN(CC1)C2=CC=CC=C2

InChI

InChI=1S/C15H18N2O3/c1-20-15(19)8-7-14(18)17-11-9-16(10-12-17)13-5-3-2-4-6-13/h2-8H,9-12H2,1H3/b8-7+