2-methylpropyl 3-[5-(4-chloranyl-3-nitro-phenyl)furan-2-yl]-2-cyano-prop-2-enoate

Systemtic Name: 2-methylpropyl 3-[5-(4-chloranyl-3-nitro-phenyl)furan-2-yl]-2-cyano-prop-2-enoate Openeye Name: isobutyl 3-[5-(4-chloro-3-nitro-phenyl)-2-furyl]-2-cyano-prop-2-enoate CAS Name: 3-[5-(4-chloro-3-nitrophenyl)-2-furanyl]-2-cyano-2-propenoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-2-cyanoprop-2-enoate Traditional Name: 3-[5-(4-chloro-3-nitro-phenyl)-2-furyl]-2-cyano-acrylic acid isobutyl ester Formula: C18H15ClN2O5 MolecularWeight: 374.7751

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(=CC1=CC=C(O1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)COC(=O)C(=CC1=CC=C(O1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H15ClN2O5/c1-11(2)10-25-18(22)13(9-20)7-14-4-6-17(26-14)12-3-5-15(19)16(8-12)21(23)24/h3-8,11H,10H2,1-2H3