(Z)-2-(4-methylpiperidin-1-yl)carbonyl-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (Z)-2-(4-methylpiperidin-1-yl)carbonyl-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile Openeye Name: (Z)-2-(4-methylpiperidine-1-carbonyl)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile CAS Name: (Z)-2-[(4-methyl-1-piperidinyl)-oxomethyl]-3-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-2-propenenitrile IUPAC Name: (Z)-2-(4-methylpiperidine-1-carbonyl)-3-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enenitrile Traditional Name: (Z)-2-(4-methylpiperidine-1-carbonyl)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acrylonitrile Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C#N

Isomeric SMILES

CC1CCN(CC1)C(=O)/C(=C\C2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)/C#N

InChI

InChI=1S/C25H23N5O3/c1-18-11-13-28(14-12-18)25(31)20(16-26)15-21-17-29(22-5-3-2-4-6-22)27-24(21)19-7-9-23(10-8-19)30(32)33/h2-10,15,17-18H,11-14H2,1H3/b20-15-