6-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbonitrile

Systemtic Name: 6-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbonitrile Openeye Name: 6-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxo-chromene-3-carbonitrile CAS Name: 6-ethyl-4-(4-methyl-1-piperazin-4-iumyl)-2-oxo-1-benzopyran-3-carbonitrile IUPAC Name: 6-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxochromene-3-carbonitrile Traditional Name: 6-ethyl-2-keto-4-(4-methylpiperazin-4-ium-1-yl)chromene-3-carbonitrile Formula: C17H20N3O2+ MolecularWeight: 298.3596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=O)C(=C2N3CC[NH+](CC3)C)C#N

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=O)C(=C2N3CC[NH+](CC3)C)C#N

InChI

InChI=1S/C17H19N3O2/c1-3-12-4-5-15-13(10-12)16(14(11-18)17(21)22-15)20-8-6-19(2)7-9-20/h4-5,10H,3,6-9H2,1-2H3/p+1