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

Systemtic Name: 4-[(4-ethylpiperazin-1-ium-1-yl)methyl]-7-methyl-2-oxidanylidene-chromen-6-olate Openeye Name: 4-[(4-ethylpiperazin-1-ium-1-yl)methyl]-7-methyl-2-oxo-chromen-6-olate CAS Name: 4-[(4-ethyl-1-piperazin-1-iumyl)methyl]-7-methyl-2-oxo-1-benzopyran-6-olate IUPAC Name: 4-[(4-ethylpiperazin-1-ium-1-yl)methyl]-7-methyl-2-oxochromen-6-olate Traditional Name: 4-[(4-ethylpiperazin-1-ium-1-yl)methyl]-2-keto-7-methyl-chromen-6-olate Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C

Isomeric SMILES

CCN1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C

InChI

InChI=1S/C17H22N2O3/c1-3-18-4-6-19(7-5-18)11-13-9-17(21)22-16-8-12(2)15(20)10-14(13)16/h8-10,20H,3-7,11H2,1-2H3