5-[4-(3-chloranylpropyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione

Systemtic Name: 5-[4-(3-chloranylpropyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione Openeye Name: 5-[4-(3-chloropropyl)-3-oxo-1,4-benzoxazin-6-yl]-2-(1-hydroxypropylidene)cyclohexane-1,3-dione CAS Name: 5-[4-(3-chloropropyl)-3-oxo-1,4-benzoxazin-6-yl]-2-(1-hydroxypropylidene)cyclohexane-1,3-dione IUPAC Name: 5-[4-(3-chloropropyl)-3-oxo-1,4-benzoxazin-6-yl]-2-(1-hydroxypropylidene)cyclohexane-1,3-dione Traditional Name: 5-[4-(3-chloropropyl)-3-keto-1,4-benzoxazin-6-yl]-2-(1-hydroxypropylidene)cyclohexane-1,3-quinone Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)CC(CC1=O)C2=CC3=C(C=C2)OCC(=O)N3CCCCl)O

Isomeric SMILES

CCC(=C1C(=O)CC(CC1=O)C2=CC3=C(C=C2)OCC(=O)N3CCCCl)O

InChI

InChI=1S/C20H22ClNO5/c1-2-15(23)20-16(24)9-13(10-17(20)25)12-4-5-18-14(8-12)22(7-3-6-21)19(26)11-27-18/h4-5,8,13,23H,2-3,6-7,9-11H2,1H3