N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C21H21ClN4O5 MolecularWeight: 444.86824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O5/c22-14-4-6-17(24-8-2-1-3-9-24)16(10-14)23-20(27)12-25-18-11-15(26(29)30)5-7-19(18)31-13-21(25)28/h4-7,10-11H,1-3,8-9,12-13H2,(H,23,27)