(E)-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-3-(5-nitrofuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-3-(5-nitrofuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(5-nitro-2-furyl)prop-2-enamide CAS Name: (E)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(5-nitro-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(5-nitrofuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]-3-(5-nitro-2-furyl)acrylamide Formula: C16H13N3O6 MolecularWeight: 343.29092

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O6/c1-9-16(21)18-12-8-10(2-5-13(12)24-9)17-14(20)6-3-11-4-7-15(25-11)19(22)23/h2-9H,1H3,(H,17,20)(H,18,21)/b6-3+/t9-/m0/s1