6-chloranyl-2-methyl-3-oxidanylidene-4-phenethyl-1,4-benzoxazine-8-carboxylic acid

Systemtic Name: 6-chloranyl-2-methyl-3-oxidanylidene-4-phenethyl-1,4-benzoxazine-8-carboxylic acid Openeye Name: 6-chloro-2-methyl-3-oxo-4-phenethyl-1,4-benzoxazine-8-carboxylic acid CAS Name: 6-chloro-2-methyl-3-oxo-4-phenethyl-1,4-benzoxazine-8-carboxylic acid IUPAC Name: 6-chloro-2-methyl-3-oxo-4-phenethyl-1,4-benzoxazine-8-carboxylic acid Traditional Name: 6-chloro-3-keto-2-methyl-4-phenethyl-1,4-benzoxazine-8-carboxylic acid Formula: C18H16ClNO4 MolecularWeight: 345.77694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)O)CCC3=CC=CC=C3

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)O)CCC3=CC=CC=C3

InChI

InChI=1S/C18H16ClNO4/c1-11-17(21)20(8-7-12-5-3-2-4-6-12)15-10-13(19)9-14(18(22)23)16(15)24-11/h2-6,9-11H,7-8H2,1H3,(H,22,23)