2-oxidanylidene-4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]methyl]chromen-6-olate

Systemtic Name: 2-oxidanylidene-4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]methyl]chromen-6-olate Openeye Name: 4-[[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]methyl]-2-oxo-chromen-6-olate CAS Name: 2-oxo-4-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumyl]methyl]-1-benzopyran-6-olate IUPAC Name: 2-oxo-4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]methyl]chromen-6-olate Traditional Name: 4-[[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]methyl]-2-keto-chromen-6-olate Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=O)OC3=C2C=C(C=C3)[O-])CC=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=O)OC3=C2C=C(C=C3)[O-])C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H24N2O3/c26-20-8-9-22-21(16-20)19(15-23(27)28-22)17-25-13-11-24(12-14-25)10-4-7-18-5-2-1-3-6-18/h1-9,15-16,26H,10-14,17H2/b7-4+