ethyl 4-[4-(3-oxidanylidene-3-phenyl-prop-1-enyl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(3-oxidanylidene-3-phenyl-prop-1-enyl)piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(3-oxo-3-phenyl-prop-1-enyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-(3-oxo-3-phenylprop-1-enyl)-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-oxo-3-phenylprop-1-enyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(3-keto-3-phenyl-prop-1-enyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C=CC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C=CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5S/c1-2-29-22(26)19-8-10-20(11-9-19)30(27,28)24-16-14-23(15-17-24)13-12-21(25)18-6-4-3-5-7-18/h3-13H,2,14-17H2,1H3