(E)-1-[4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-[3-(cyclopropylamino)-4-nitrophenyl]-1-piperazinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazino]-3-phenyl-prop-2-en-1-one Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=CC(=C2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=CC(=C2)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O3/c27-22(11-6-17-4-2-1-3-5-17)25-14-12-24(13-15-25)19-9-10-21(26(28)29)20(16-19)23-18-7-8-18/h1-6,9-11,16,18,23H,7-8,12-15H2/b11-6+