ethyl 2-cyano-3-(3-methyl-1-phenyl-5-piperidin-1-yl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: ethyl 2-cyano-3-(3-methyl-1-phenyl-5-piperidin-1-yl-pyrazol-4-yl)prop-2-enoate Openeye Name: ethyl 2-cyano-3-[3-methyl-1-phenyl-5-(1-piperidyl)pyrazol-4-yl]prop-2-enoate CAS Name: 2-cyano-3-[3-methyl-1-phenyl-5-(1-piperidinyl)-4-pyrazolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-(3-methyl-1-phenyl-5-piperidin-1-ylpyrazol-4-yl)prop-2-enoate Traditional Name: 2-cyano-3-(3-methyl-1-phenyl-5-piperidino-pyrazol-4-yl)acrylic acid ethyl ester Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(N=C1C)C2=CC=CC=C2)N3CCCCC3)C#N

Isomeric SMILES

CCOC(=O)C(=CC1=C(N(N=C1C)C2=CC=CC=C2)N3CCCCC3)C#N

InChI

InChI=1S/C21H24N4O2/c1-3-27-21(26)17(15-22)14-19-16(2)23-25(18-10-6-4-7-11-18)20(19)24-12-8-5-9-13-24/h4,6-7,10-11,14H,3,5,8-9,12-13H2,1-2H3