6-[(E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]prop-2-enoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]prop-2-enoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]prop-2-enoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(E)-3-[5-(4-chloro-2-nitrophenyl)-2-furanyl]-1-oxoprop-2-enyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(E)-3-[5-(4-chloro-2-nitrophenyl)furan-2-yl]prop-2-enoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]acryloyl]-4H-1,4-benzoxazin-3-one Formula: C21H13ClN2O6 MolecularWeight: 424.79072

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)C=CC3=CC=C(O3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)/C=C/C3=CC=C(O3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H13ClN2O6/c22-13-2-5-15(17(10-13)24(27)28)19-8-4-14(30-19)3-6-18(25)12-1-7-20-16(9-12)23-21(26)11-29-20/h1-10H,11H2,(H,23,26)/b6-3+