4-[(4-ethoxycarbonylpiperazin-1-ium-1-yl)methyl]-6-ethyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 4-[(4-ethoxycarbonylpiperazin-1-ium-1-yl)methyl]-6-ethyl-2-oxidanylidene-chromen-7-olate Openeye Name: 4-[(4-ethoxycarbonylpiperazin-1-ium-1-yl)methyl]-6-ethyl-2-oxo-chromen-7-olate CAS Name: 4-[(4-ethoxycarbonyl-1-piperazin-1-iumyl)methyl]-6-ethyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 4-[(4-ethoxycarbonylpiperazin-1-ium-1-yl)methyl]-6-ethyl-2-oxochromen-7-olate Traditional Name: 4-[(4-carbethoxypiperazin-1-ium-1-yl)methyl]-6-ethyl-2-keto-chromen-7-olate Formula: C19H24N2O5 MolecularWeight: 360.40426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+]3CCN(CC3)C(=O)OCC)[O-]

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+]3CCN(CC3)C(=O)OCC)[O-]

InChI

InChI=1S/C19H24N2O5/c1-3-13-9-15-14(10-18(23)26-17(15)11-16(13)22)12-20-5-7-21(8-6-20)19(24)25-4-2/h9-11,22H,3-8,12H2,1-2H3