[1,4-bis(phenylmethyl)piperazin-2-yl]methyl N-octylcarbamate

Systemtic Name: [1,4-bis(phenylmethyl)piperazin-2-yl]methyl N-octylcarbamate Openeye Name: (1,4-dibenzylpiperazin-2-yl)methyl N-octylcarbamate CAS Name: N-octylcarbamic acid [1,4-bis(phenylmethyl)-2-piperazinyl]methyl ester IUPAC Name: (1,4-dibenzylpiperazin-2-yl)methyl N-octylcarbamate Traditional Name: N-octylcarbamic acid (1,4-dibenzylpiperazin-2-yl)methyl ester Formula: C28H41N3O2 MolecularWeight: 451.64404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)OCC1CN(CCN1CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCNC(=O)OCC1CN(CCN1CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C28H41N3O2/c1-2-3-4-5-6-13-18-29-28(32)33-24-27-23-30(21-25-14-9-7-10-15-25)19-20-31(27)22-26-16-11-8-12-17-26/h7-12,14-17,27H,2-6,13,18-24H2,1H3,(H,29,32)