oct-2-ynyl 4-(2-methylphenyl)piperazine-1-carboxylate

Systemtic Name: oct-2-ynyl 4-(2-methylphenyl)piperazine-1-carboxylate Openeye Name: oct-2-ynyl 4-(o-tolyl)piperazine-1-carboxylate CAS Name: 4-(2-methylphenyl)-1-piperazinecarboxylic acid oct-2-ynyl ester IUPAC Name: oct-2-ynyl 4-(2-methylphenyl)piperazine-1-carboxylate Traditional Name: 4-(o-tolyl)piperazine-1-carboxylic acid oct-2-ynyl ester Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CCOC(=O)N1CCN(CC1)C2=CC=CC=C2C

Isomeric SMILES

CCCCCC#CCOC(=O)N1CCN(CC1)C2=CC=CC=C2C

InChI

InChI=1S/C20H28N2O2/c1-3-4-5-6-7-10-17-24-20(23)22-15-13-21(14-16-22)19-12-9-8-11-18(19)2/h8-9,11-12H,3-6,13-17H2,1-2H3