N-(4-butylphenyl)-3-(4-chloranyl-3-nitro-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: N-(4-butylphenyl)-3-(4-chloranyl-3-nitro-phenyl)-2-cyano-prop-2-enamide Openeye Name: N-(4-butylphenyl)-3-(4-chloro-3-nitro-phenyl)-2-cyano-prop-2-enamide CAS Name: N-(4-butylphenyl)-3-(4-chloro-3-nitrophenyl)-2-cyano-2-propenamide IUPAC Name: N-(4-butylphenyl)-3-(4-chloro-3-nitrophenyl)-2-cyanoprop-2-enamide Traditional Name: N-(4-butylphenyl)-3-(4-chloro-3-nitro-phenyl)-2-cyano-acrylamide Formula: C20H18ClN3O3 MolecularWeight: 383.82822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H18ClN3O3/c1-2-3-4-14-5-8-17(9-6-14)23-20(25)16(13-22)11-15-7-10-18(21)19(12-15)24(26)27/h5-12H,2-4H2,1H3,(H,23,25)