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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)O)CCCC3=CC=CC=C3

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)O)CCCC3=CC=CC=C3

InChI

InChI=1S/C19H18ClNO4/c1-12-18(22)21(9-5-8-13-6-3-2-4-7-13)16-11-14(20)10-15(19(23)24)17(16)25-12/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,23,24)