2-ethyl-6-[(2-ethyl-4-oxidanylidene-3,1-benzoxazin-6-yl)methyl]-3,1-benzoxazin-4-one

Systemtic Name: 2-ethyl-6-[(2-ethyl-4-oxidanylidene-3,1-benzoxazin-6-yl)methyl]-3,1-benzoxazin-4-one Openeye Name: 2-ethyl-6-[(2-ethyl-4-oxo-3,1-benzoxazin-6-yl)methyl]-3,1-benzoxazin-4-one CAS Name: 2-ethyl-6-[(2-ethyl-4-oxo-3,1-benzoxazin-6-yl)methyl]-3,1-benzoxazin-4-one IUPAC Name: 2-ethyl-6-[(2-ethyl-4-oxo-3,1-benzoxazin-6-yl)methyl]-3,1-benzoxazin-4-one Traditional Name: 2-ethyl-6-[(2-ethyl-4-keto-3,1-benzoxazin-6-yl)methyl]-3,1-benzoxazin-4-one Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)CC3=CC4=C(C=C3)N=C(OC4=O)CC)C(=O)O1

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)CC3=CC4=C(C=C3)N=C(OC4=O)CC)C(=O)O1

InChI

InChI=1S/C21H18N2O4/c1-3-18-22-16-7-5-12(10-14(16)20(24)26-18)9-13-6-8-17-15(11-13)21(25)27-19(4-2)23-17/h5-8,10-11H,3-4,9H2,1-2H3