ethyl 4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazine-2-carboxylate

Systemtic Name: ethyl 4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazine-2-carboxylate Openeye Name: ethyl 4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazine-2-carboxylate CAS Name: 4-(4-cyano-5-methyl-4-phenylhexyl)-2-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-cyano-5-methyl-4-phenylhexyl)piperazine-2-carboxylate Traditional Name: 4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazine-2-carboxylic acid ethyl ester Formula: C21H31N3O2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CCN1)CCCC(C#N)(C2=CC=CC=C2)C(C)C

Isomeric SMILES

CCOC(=O)C1CN(CCN1)CCCC(C#N)(C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H31N3O2/c1-4-26-20(25)19-15-24(14-12-23-19)13-8-11-21(16-22,17(2)3)18-9-6-5-7-10-18/h5-7,9-10,17,19,23H,4,8,11-15H2,1-3H3