4,4-dimethyl-6-(5-nitro-1H-pyrrol-2-yl)-1H-3,1-benzoxazin-2-one

Systemtic Name: 4,4-dimethyl-6-(5-nitro-1H-pyrrol-2-yl)-1H-3,1-benzoxazin-2-one Openeye Name: 4,4-dimethyl-6-(5-nitro-1H-pyrrol-2-yl)-1H-3,1-benzoxazin-2-one CAS Name: 4,4-dimethyl-6-(5-nitro-1H-pyrrol-2-yl)-1H-3,1-benzoxazin-2-one IUPAC Name: 4,4-dimethyl-6-(5-nitro-1H-pyrrol-2-yl)-1H-3,1-benzoxazin-2-one Traditional Name: 4,4-dimethyl-6-(5-nitro-1H-pyrrol-2-yl)-1H-3,1-benzoxazin-2-one Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC=C(N3)[N+](=O)[O-])NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC=C(N3)[N+](=O)[O-])NC(=O)O1)C

InChI

InChI=1S/C14H13N3O4/c1-14(2)9-7-8(3-4-11(9)16-13(18)21-14)10-5-6-12(15-10)17(19)20/h3-7,15H,1-2H3,(H,16,18)