2-[1-(ethoxyamino)propylidene]-5-(3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)cyclohexane-1,3-dione

Systemtic Name: 2-[1-(ethoxyamino)propylidene]-5-(3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)cyclohexane-1,3-dione Openeye Name: 2-[1-(ethoxyamino)propylidene]-5-(3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)cyclohexane-1,3-dione CAS Name: 2-[1-(ethoxyamino)propylidene]-5-(3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)cyclohexane-1,3-dione IUPAC Name: 2-[1-(ethoxyamino)propylidene]-5-(3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)cyclohexane-1,3-dione Traditional Name: 2-[1-(ethoxyamino)propylidene]-5-(3-keto-4-propargyl-1,4-benzoxazin-6-yl)cyclohexane-1,3-quinone Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)CC(CC1=O)C2=CC3=C(C=C2)OCC(=O)N3CC#C)NOCC

Isomeric SMILES

CCC(=C1C(=O)CC(CC1=O)C2=CC3=C(C=C2)OCC(=O)N3CC#C)NOCC

InChI

InChI=1S/C22H24N2O5/c1-4-9-24-17-10-14(7-8-20(17)28-13-21(24)27)15-11-18(25)22(19(26)12-15)16(5-2)23-29-6-3/h1,7-8,10,15,23H,5-6,9,11-13H2,2-3H3