(2R)-2-[(2E)-6-chloranyl-2-(furan-2-ylmethylidene)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: (2R)-2-[(2E)-6-chloranyl-2-(furan-2-ylmethylidene)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: (2R)-2-[(2E)-6-chloro-2-(2-furylmethylene)-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2R)-2-[(2E)-6-chloro-2-(2-furanylmethylidene)-3-oxo-1,4-benzoxazin-4-yl]propanoate IUPAC Name: (2R)-2-[(2E)-6-chloro-2-(furan-2-ylmethylidene)-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2R)-2-[(2E)-6-chloro-2-(2-furfurylidene)-3-keto-1,4-benzoxazin-4-yl]propionate Formula: C16H11ClNO5- MolecularWeight: 332.71524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C2=C(C=CC(=C2)Cl)OC(=CC3=CC=CO3)C1=O

Isomeric SMILES

C[C@H](C(=O)[O-])N1C2=C(C=CC(=C2)Cl)O/C(=C/C3=CC=CO3)/C1=O

InChI

InChI=1S/C16H12ClNO5/c1-9(16(20)21)18-12-7-10(17)4-5-13(12)23-14(15(18)19)8-11-3-2-6-22-11/h2-9H,1H3,(H,20,21)/p-1/b14-8+/t9-/m1/s1