(1-cyanoindolizin-2-yl)methyl (E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl (E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoate Openeye Name: (1-cyanoindolizin-2-yl)methyl (E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-2-propenoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl (E)-3-(4-chloro-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)acrylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C19H12ClN3O4 MolecularWeight: 381.76928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC2=C(C(=CN2C=C1)COC(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C19H12ClN3O4/c20-16-6-4-13(9-18(16)23(25)26)5-7-19(24)27-12-14-11-22-8-2-1-3-17(22)15(14)10-21/h1-9,11H,12H2/b7-5+