hept-3-ynyl 4-(2-methylphenyl)piperazine-1-carboxylate

Systemtic Name: hept-3-ynyl 4-(2-methylphenyl)piperazine-1-carboxylate Openeye Name: hept-3-ynyl 4-(o-tolyl)piperazine-1-carboxylate CAS Name: 4-(2-methylphenyl)-1-piperazinecarboxylic acid hept-3-ynyl ester IUPAC Name: hept-3-ynyl 4-(2-methylphenyl)piperazine-1-carboxylate Traditional Name: 4-(o-tolyl)piperazine-1-carboxylic acid hept-3-ynyl ester Formula: C19H26N2O2 MolecularWeight: 314.42194

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCCOC(=O)N1CCN(CC1)C2=CC=CC=C2C

Isomeric SMILES

CCCC#CCCOC(=O)N1CCN(CC1)C2=CC=CC=C2C

InChI

InChI=1S/C19H26N2O2/c1-3-4-5-6-9-16-23-19(22)21-14-12-20(13-15-21)18-11-8-7-10-17(18)2/h7-8,10-11H,3-4,9,12-16H2,1-2H3