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

Systemtic Name: methyl 4-[(E)-3-oxidanylidene-3-piperazin-1-yl-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-oxo-3-piperazin-1-yl-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-oxo-3-(1-piperazinyl)prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-oxo-3-piperazin-1-ylprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-piperazino-prop-1-enyl]benzoic acid methyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)N2CCNCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)N2CCNCC2

InChI

InChI=1S/C15H18N2O3/c1-20-15(19)13-5-2-12(3-6-13)4-7-14(18)17-10-8-16-9-11-17/h2-7,16H,8-11H2,1H3/b7-4+