2-[4-(4-methylpiperazin-1-ium-1-ylidene)cyclohexa-2,5-dien-1-ylidene]chromene-3,4-diol

Systemtic Name: 2-[4-(4-methylpiperazin-1-ium-1-ylidene)cyclohexa-2,5-dien-1-ylidene]chromene-3,4-diol Openeye Name: 2-[4-(4-methylpiperazin-1-ium-1-ylidene)cyclohexa-2,5-dien-1-ylidene]chromene-3,4-diol CAS Name: 2-[4-(4-methyl-1-piperazin-1-iumylidene)-1-cyclohexa-2,5-dienylidene]-1-benzopyran-3,4-diol IUPAC Name: 2-[4-(4-methylpiperazin-1-ium-1-ylidene)cyclohexa-2,5-dien-1-ylidene]chromene-3,4-diol Traditional Name: 2-[4-(4-methylpiperazin-1-ium-1-ylidene)cyclohexa-2,5-dien-1-ylidene]chromene-3,4-diol Formula: C20H21N2O3+ MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=C2C=CC(=C3C(=C(C4=CC=CC=C4O3)O)O)C=C2)CC1

Isomeric SMILES

CN1CC[N+](=C2C=CC(=C3C(=C(C4=CC=CC=C4O3)O)O)C=C2)CC1

InChI

InChI=1S/C20H20N2O3/c1-21-10-12-22(13-11-21)15-8-6-14(7-9-15)20-19(24)18(23)16-4-2-3-5-17(16)25-20/h2-9,24H,10-13H2,1H3/p+1