(4R)-2-[(4-methylpiperazin-4-ium-1-yl)methylideneamino]-7-oxidanyl-4-phenyl-4H-chromene-3-carbonitrile

Systemtic Name: (4R)-2-[(4-methylpiperazin-4-ium-1-yl)methylideneamino]-7-oxidanyl-4-phenyl-4H-chromene-3-carbonitrile Openeye Name: (4R)-7-hydroxy-2-[(4-methylpiperazin-4-ium-1-yl)methyleneamino]-4-phenyl-4H-chromene-3-carbonitrile CAS Name: (4R)-7-hydroxy-2-[(4-methyl-1-piperazin-4-iumyl)methylideneamino]-4-phenyl-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4R)-7-hydroxy-2-[(4-methylpiperazin-4-ium-1-yl)methylideneamino]-4-phenyl-4H-chromene-3-carbonitrile Traditional Name: (4R)-7-hydroxy-2-[(4-methylpiperazin-4-ium-1-yl)methyleneamino]-4-phenyl-4H-chromene-3-carbonitrile Formula: C22H23N4O2+ MolecularWeight: 375.44362

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C=NC2=C(C(C3=C(O2)C=C(C=C3)O)C4=CC=CC=C4)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)C=NC2=C([C@@H](C3=C(O2)C=C(C=C3)O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C22H22N4O2/c1-25-9-11-26(12-10-25)15-24-22-19(14-23)21(16-5-3-2-4-6-16)18-8-7-17(27)13-20(18)28-22/h2-8,13,15,21,27H,9-12H2,1H3/p+1/t21-/m1/s1