2-[(10-methylphenothiazin-3-yl)methylidene]cyclohexane-1,3-dione

Systemtic Name: 2-[(10-methylphenothiazin-3-yl)methylidene]cyclohexane-1,3-dione Openeye Name: 2-[(10-methylphenothiazin-3-yl)methylene]cyclohexane-1,3-dione CAS Name: 2-[(10-methyl-3-phenothiazinyl)methylidene]cyclohexane-1,3-dione IUPAC Name: 2-[(10-methylphenothiazin-3-yl)methylidene]cyclohexane-1,3-dione Traditional Name: 2-[(10-methylphenothiazin-3-yl)methylene]cyclohexane-1,3-quinone Formula: C20H17NO2S MolecularWeight: 335.41948

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C=C3C(=O)CCCC3=O)SC4=CC=CC=C41

Isomeric SMILES

CN1C2=C(C=C(C=C2)C=C3C(=O)CCCC3=O)SC4=CC=CC=C41

InChI

InChI=1S/C20H17NO2S/c1-21-15-5-2-3-8-19(15)24-20-12-13(9-10-16(20)21)11-14-17(22)6-4-7-18(14)23/h2-3,5,8-12H,4,6-7H2,1H3