(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-(2-methoxy-5-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)-N-(2-methoxy-5-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-nitro-phenyl)acrylamide Formula: C18H21ClN4O4 MolecularWeight: 392.83674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)Cl

InChI

InChI=1S/C18H21ClN4O4/c1-4-5-10-22-18(19)14(12(2)21-22)7-9-17(24)20-15-11-13(23(25)26)6-8-16(15)27-3/h6-9,11H,4-5,10H2,1-3H3,(H,20,24)/b9-7+