6-chloranyl-2-ethyl-2-methyl-3-oxidanylidene-4-(phenylmethyl)-1,4-benzoxazine-8-carboxylic acid

Systemtic Name: 6-chloranyl-2-ethyl-2-methyl-3-oxidanylidene-4-(phenylmethyl)-1,4-benzoxazine-8-carboxylic acid Openeye Name: 4-benzyl-6-chloro-2-ethyl-2-methyl-3-oxo-1,4-benzoxazine-8-carboxylic acid CAS Name: 6-chloro-2-ethyl-2-methyl-3-oxo-4-(phenylmethyl)-1,4-benzoxazine-8-carboxylic acid IUPAC Name: 4-benzyl-6-chloro-2-ethyl-2-methyl-3-oxo-1,4-benzoxazine-8-carboxylic acid Traditional Name: 4-benzyl-6-chloro-2-ethyl-3-keto-2-methyl-1,4-benzoxazine-8-carboxylic acid Formula: C19H18ClNO4 MolecularWeight: 359.80352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)O)CC3=CC=CC=C3)C

Isomeric SMILES

CCC1(C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)O)CC3=CC=CC=C3)C

InChI

InChI=1S/C19H18ClNO4/c1-3-19(2)18(24)21(11-12-7-5-4-6-8-12)15-10-13(20)9-14(17(22)23)16(15)25-19/h4-10H,3,11H2,1-2H3,(H,22,23)