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

Systemtic Name: 7-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-chromene-3-carbonitrile Openeye Name: 7-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxo-chromene-3-carbonitrile CAS Name: 7-methyl-4-(4-methyl-1-piperazin-4-iumyl)-2-oxo-1-benzopyran-3-carbonitrile IUPAC Name: 7-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxochromene-3-carbonitrile Traditional Name: 2-keto-7-methyl-4-(4-methylpiperazin-4-ium-1-yl)chromene-3-carbonitrile Formula: C16H18N3O2+ MolecularWeight: 284.33302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O2/c1-11-3-4-12-14(9-11)21-16(20)13(10-17)15(12)19-7-5-18(2)6-8-19/h3-4,9H,5-8H2,1-2H3/p+1