(E)-3-(3-nitrophenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-nitrophenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3-nitrophenyl)-1-[4-(3-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3-nitrophenyl)-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-nitrophenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3-nitrophenyl)-1-[4-(3-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O3/c24-19(7-6-16-3-1-5-18(13-16)23(25)26)22-11-9-21(10-12-22)15-17-4-2-8-20-14-17/h1-8,13-14H,9-12,15H2/b7-6+