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

Systemtic Name: (E)-3-(3-nitrophenyl)-N-[4-(4-propanoylpiperazin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-[4-(4-propanoylpiperazin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-[4-(4-propanoylpiperazin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-[4-(4-propionylpiperazino)phenyl]acrylamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4/c1-2-22(28)25-14-12-24(13-15-25)19-9-7-18(8-10-19)23-21(27)11-6-17-4-3-5-20(16-17)26(29)30/h3-11,16H,2,12-15H2,1H3,(H,23,27)/b11-6+