4-(4-ethylpiperazin-4-ium-1-yl)-7-methyl-2-oxidanylidene-chromene-3-carbaldehyde

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-7-methyl-2-oxidanylidene-chromene-3-carbaldehyde Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-7-methyl-2-oxo-chromene-3-carbaldehyde CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-7-methyl-2-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-7-methyl-2-oxochromene-3-carbaldehyde Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-2-keto-7-methyl-chromene-3-carbaldehyde Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C(=O)OC3=C2C=CC(=C3)C)C=O

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C(=O)OC3=C2C=CC(=C3)C)C=O

InChI

InChI=1S/C17H20N2O3/c1-3-18-6-8-19(9-7-18)16-13-5-4-12(2)10-15(13)22-17(21)14(16)11-20/h4-5,10-11H,3,6-9H2,1-2H3/p+1