2-[4-(4-methylphenyl)piperazin-1-yl]ethyl (E)-3-pyridin-3-ylprop-2-enoate

Systemtic Name: 2-[4-(4-methylphenyl)piperazin-1-yl]ethyl (E)-3-pyridin-3-ylprop-2-enoate Openeye Name: 2-[4-(p-tolyl)piperazin-1-yl]ethyl (E)-3-(3-pyridyl)prop-2-enoate CAS Name: (E)-3-(3-pyridinyl)-2-propenoic acid 2-[4-(4-methylphenyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(4-methylphenyl)piperazin-1-yl]ethyl (E)-3-pyridin-3-ylprop-2-enoate Traditional Name: (E)-3-(3-pyridyl)acrylic acid 2-[4-(p-tolyl)piperazino]ethyl ester Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)CCOC(=O)C=CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)CCOC(=O)/C=C/C3=CN=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-18-4-7-20(8-5-18)24-13-11-23(12-14-24)15-16-26-21(25)9-6-19-3-2-10-22-17-19/h2-10,17H,11-16H2,1H3/b9-6+