ethyl (Z)-3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (Z)-3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-cyano-prop-2-enoate Openeye Name: ethyl (Z)-3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-cyano-prop-2-enoate CAS Name: (Z)-3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-cyano-acrylic acid ethyl ester Formula: C17H20ClN3O2 MolecularWeight: 333.8126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN1CCN(CC1)C2=C(C=CC(=C2)Cl)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C\N1CCN(CC1)C2=C(C=CC(=C2)Cl)C)/C#N

InChI

InChI=1S/C17H20ClN3O2/c1-3-23-17(22)14(11-19)12-20-6-8-21(9-7-20)16-10-15(18)5-4-13(16)2/h4-5,10,12H,3,6-9H2,1-2H3/b14-12-