N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-3-oxo-4H-1,4-benzoxazine-7-carboxamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-3-oxo-4H-1,4-benzoxazine-7-carboxamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-3-oxo-4H-1,4-benzoxazine-7-carboxamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-3-keto-N-methyl-4H-1,4-benzoxazine-7-carboxamide Formula: C17H14ClN3O5 MolecularWeight: 375.76316

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2=CC3=C(C=C2)NC(=O)CO3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2=CC3=C(C=C2)NC(=O)CO3

InChI

InChI=1S/C17H14ClN3O5/c1-20(8-11-6-12(21(24)25)3-4-13(11)18)17(23)10-2-5-14-15(7-10)26-9-16(22)19-14/h2-7H,8-9H2,1H3,(H,19,22)