3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(2-methyl-5-nitro-phenyl)prop-2-enamide

Systemtic Name: 3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(2-methyl-5-nitro-phenyl)prop-2-enamide Openeye Name: 3-(4-isopentyloxy-3-methoxy-phenyl)-N-(2-methyl-5-nitro-phenyl)prop-2-enamide CAS Name: 3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(2-methyl-5-nitrophenyl)-2-propenamide IUPAC Name: 3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(2-methyl-5-nitrophenyl)prop-2-enamide Traditional Name: 3-(4-isoamoxy-3-methoxy-phenyl)-N-(2-methyl-5-nitro-phenyl)acrylamide Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C=CC2=CC(=C(C=C2)OCCC(C)C)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C=CC2=CC(=C(C=C2)OCCC(C)C)OC

InChI

InChI=1S/C22H26N2O5/c1-15(2)11-12-29-20-9-6-17(13-21(20)28-4)7-10-22(25)23-19-14-18(24(26)27)8-5-16(19)3/h5-10,13-15H,11-12H2,1-4H3,(H,23,25)