5-azanyl-2-[(E)-2-chloranylethenyl]-4-(4-methyl-3-nitro-phenyl)furan-3-one

Systemtic Name: 5-azanyl-2-[(E)-2-chloranylethenyl]-4-(4-methyl-3-nitro-phenyl)furan-3-one Openeye Name: 5-amino-2-[(E)-2-chlorovinyl]-4-(4-methyl-3-nitro-phenyl)furan-3-one CAS Name: 5-amino-2-[(E)-2-chloroethenyl]-4-(4-methyl-3-nitrophenyl)-3-furanone IUPAC Name: 5-amino-2-[(E)-2-chloroethenyl]-4-(4-methyl-3-nitrophenyl)furan-3-one Traditional Name: 5-amino-2-[(E)-2-chlorovinyl]-4-(4-methyl-3-nitro-phenyl)furan-3-one Formula: C13H11ClN2O4 MolecularWeight: 294.69044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(OC(C2=O)C=CCl)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(OC(C2=O)/C=C/Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClN2O4/c1-7-2-3-8(6-9(7)16(18)19)11-12(17)10(4-5-14)20-13(11)15/h2-6,10H,15H2,1H3/b5-4+