5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbaldehyde

Systemtic Name: 5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbaldehyde Openeye Name: 5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxo-chromene-3-carbaldehyde CAS Name: 5,7-dimethyl-4-(4-methyl-1-piperazin-4-iumyl)-2-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxochromene-3-carbaldehyde Traditional Name: 2-keto-5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)chromene-3-carbaldehyde Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OC(=O)C(=C2N3CC[NH+](CC3)C)C=O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)OC(=O)C(=C2N3CC[NH+](CC3)C)C=O)C

InChI

InChI=1S/C17H20N2O3/c1-11-8-12(2)15-14(9-11)22-17(21)13(10-20)16(15)19-6-4-18(3)5-7-19/h8-10H,4-7H2,1-3H3/p+1