3-[(E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]prop-2-enoyl]-6-methyl-pyran-2,4-dione

Systemtic Name: 3-[(E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]prop-2-enoyl]-6-methyl-pyran-2,4-dione Openeye Name: 3-[(E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]prop-2-enoyl]-6-methyl-pyran-2,4-dione CAS Name: 3-[(E)-3-[5-(4-chloro-2-nitrophenyl)-2-furanyl]-1-oxoprop-2-enyl]-6-methylpyran-2,4-dione IUPAC Name: 3-[(E)-3-[5-(4-chloro-2-nitrophenyl)furan-2-yl]prop-2-enoyl]-6-methylpyran-2,4-dione Traditional Name: 3-[(E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]acryloyl]-6-methyl-pyran-2,4-quinone Formula: C19H12ClNO7 MolecularWeight: 401.75408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)C=CC2=CC=C(O2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)/C=C/C2=CC=C(O2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H12ClNO7/c1-10-8-16(23)18(19(24)27-10)15(22)6-3-12-4-7-17(28-12)13-5-2-11(20)9-14(13)21(25)26/h2-9,18H,1H3/b6-3+