(2R)-2-[6-[(2S)-2-chloranylpropanoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: (2R)-2-[6-[(2S)-2-chloranylpropanoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: (2R)-2-[6-[(2S)-2-chloropropanoyl]-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2R)-2-[6-[(2S)-2-chloro-1-oxopropyl]-3-oxo-1,4-benzoxazin-4-yl]propanoate IUPAC Name: (2R)-2-[6-[(2S)-2-chloropropanoyl]-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2R)-2-[6-[(2S)-2-chloropropanoyl]-3-keto-1,4-benzoxazin-4-yl]propionate Formula: C14H13ClNO5- MolecularWeight: 310.70972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C(=O)COC2=C1C=C(C=C2)C(=O)C(C)Cl

Isomeric SMILES

C[C@H](C(=O)[O-])N1C(=O)COC2=C1C=C(C=C2)C(=O)[C@H](C)Cl

InChI

InChI=1S/C14H14ClNO5/c1-7(15)13(18)9-3-4-11-10(5-9)16(8(2)14(19)20)12(17)6-21-11/h3-5,7-8H,6H2,1-2H3,(H,19,20)/p-1/t7-,8+/m0/s1