6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbaldehyde

Systemtic Name: 6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbaldehyde Openeye Name: 6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxo-chromene-3-carbaldehyde CAS Name: 6-methyl-4-(4-methyl-1-piperazin-4-iumyl)-2-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxochromene-3-carbaldehyde Traditional Name: 2-keto-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)chromene-3-carbaldehyde Formula: C16H19N2O3+ MolecularWeight: 287.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C(=C2N3CC[NH+](CC3)C)C=O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C(=C2N3CC[NH+](CC3)C)C=O

InChI

InChI=1S/C16H18N2O3/c1-11-3-4-14-12(9-11)15(13(10-19)16(20)21-14)18-7-5-17(2)6-8-18/h3-4,9-10H,5-8H2,1-2H3/p+1