2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(3-phenylmethoxypropyl)ethanamide

Systemtic Name: 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(3-phenylmethoxypropyl)ethanamide Openeye Name: N-(3-benzyloxypropyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(3-phenylmethoxypropyl)acetamide IUPAC Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(3-phenylmethoxypropyl)acetamide Traditional Name: N-(3-benzoxypropyl)-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O6/c24-19(21-9-4-10-28-13-15-5-2-1-3-6-15)12-22-17-11-16(23(26)27)7-8-18(17)29-14-20(22)25/h1-3,5-8,11H,4,9-10,12-14H2,(H,21,24)