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

Systemtic Name: 7-methoxy-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbaldehyde Openeye Name: 7-methoxy-4-(4-methylpiperazin-4-ium-1-yl)-2-oxo-chromene-3-carbaldehyde CAS Name: 7-methoxy-4-(4-methyl-1-piperazin-4-iumyl)-2-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 7-methoxy-4-(4-methylpiperazin-4-ium-1-yl)-2-oxochromene-3-carbaldehyde Traditional Name: 2-keto-7-methoxy-4-(4-methylpiperazin-4-ium-1-yl)chromene-3-carbaldehyde Formula: C16H19N2O4+ MolecularWeight: 303.33306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4/c1-17-5-7-18(8-6-17)15-12-4-3-11(21-2)9-14(12)22-16(20)13(15)10-19/h3-4,9-10H,5-8H2,1-2H3/p+1