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

Systemtic Name: 7-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbaldehyde Openeye Name: 7-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxo-chromene-3-carbaldehyde CAS Name: 7-methyl-4-(4-methyl-1-piperazin-4-iumyl)-2-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 7-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxochromene-3-carbaldehyde Traditional Name: 2-keto-7-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)C(=C(C(=O)O2)C=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(C(=O)O2)C=O)N3CC[NH+](CC3)C

InChI

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