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

Systemtic Name: (E)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-propenamide IUPAC Name: (E)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(4-butyrylpiperazino)phenyl]-3-(3-nitrophenyl)acrylamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O4/c1-2-4-23(29)26-15-13-25(14-16-26)20-10-8-19(9-11-20)24-22(28)12-7-18-5-3-6-21(17-18)27(30)31/h3,5-12,17H,2,4,13-16H2,1H3,(H,24,28)/b12-7+