3-[2-(3-nitrophenyl)pyrimidin-5-yl]-1-piperidin-1-yl-prop-2-en-1-one

Systemtic Name: 3-[2-(3-nitrophenyl)pyrimidin-5-yl]-1-piperidin-1-yl-prop-2-en-1-one Openeye Name: 3-[2-(3-nitrophenyl)pyrimidin-5-yl]-1-(1-piperidyl)prop-2-en-1-one CAS Name: 3-[2-(3-nitrophenyl)-5-pyrimidinyl]-1-(1-piperidinyl)-2-propen-1-one IUPAC Name: 3-[2-(3-nitrophenyl)pyrimidin-5-yl]-1-piperidin-1-ylprop-2-en-1-one Traditional Name: 3-[2-(3-nitrophenyl)pyrimidin-5-yl]-1-piperidino-prop-2-en-1-one Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C=CC2=CN=C(N=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C=CC2=CN=C(N=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3/c23-17(21-9-2-1-3-10-21)8-7-14-12-19-18(20-13-14)15-5-4-6-16(11-15)22(24)25/h4-8,11-13H,1-3,9-10H2