[5-(4-methylpiperazin-1-yl)-2,3-bis[(E)-octadec-9-enoxy]pentyl] carbamate

Systemtic Name: [5-(4-methylpiperazin-1-yl)-2,3-bis[(E)-octadec-9-enoxy]pentyl] carbamate Openeye Name: [5-(4-methylpiperazin-1-yl)-2,3-bis[(E)-octadec-9-enoxy]pentyl] carbamate CAS Name: carbamic acid [5-(4-methyl-1-piperazinyl)-2,3-bis[(E)-octadec-9-enoxy]pentyl] ester IUPAC Name: [5-(4-methylpiperazin-1-yl)-2,3-bis[(E)-octadec-9-enoxy]pentyl] carbamate Traditional Name: carbamic acid [5-(4-methylpiperazino)-2,3-bis[(E)-octadec-9-enoxy]pentyl] ester Formula: C47H91N3O4 MolecularWeight: 762.24314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC(CCN1CCN(CC1)C)C(COC(=O)N)OCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC(CCN1CCN(CC1)C)C(COC(=O)N)OCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C47H91N3O4/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-42-52-45(36-37-50-40-38-49(3)39-41-50)46(44-54-47(48)51)53-43-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18-21,45-46H,4-17,22-44H2,1-3H3,(H2,48,51)/b20-18+,21-19+