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

Systemtic Name: 4-[(4-ethoxycarbonylpiperazin-1-ium-1-yl)methyl]-7-methyl-2-oxidanylidene-chromen-6-olate Openeye Name: 4-[(4-ethoxycarbonylpiperazin-1-ium-1-yl)methyl]-7-methyl-2-oxo-chromen-6-olate CAS Name: 4-[(4-ethoxycarbonyl-1-piperazin-1-iumyl)methyl]-7-methyl-2-oxo-1-benzopyran-6-olate IUPAC Name: 4-[(4-ethoxycarbonylpiperazin-1-ium-1-yl)methyl]-7-methyl-2-oxochromen-6-olate Traditional Name: 4-[(4-carbethoxypiperazin-1-ium-1-yl)methyl]-2-keto-7-methyl-chromen-6-olate Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C

InChI

InChI=1S/C18H22N2O5/c1-3-24-18(23)20-6-4-19(5-7-20)11-13-9-17(22)25-16-8-12(2)15(21)10-14(13)16/h8-10,21H,3-7,11H2,1-2H3