(E)-N-[3-methoxy-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[3-methoxy-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[3-methoxy-4-(2-oxo-1-piperidyl)phenyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[3-methoxy-4-(2-oxo-1-piperidinyl)phenyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(2-ketopiperidino)-3-methoxy-phenyl]-3-(4-nitrophenyl)acrylamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])N3CCCCC3=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])N3CCCCC3=O

InChI

InChI=1S/C21H21N3O5/c1-29-19-14-16(8-11-18(19)23-13-3-2-4-21(23)26)22-20(25)12-7-15-5-9-17(10-6-15)24(27)28/h5-12,14H,2-4,13H2,1H3,(H,22,25)/b12-7+