2,3-bis[(E)-octadec-9-enoxy]propyl N-(2-pyrrolidin-1-ylethyl)sulfamate

Systemtic Name: 2,3-bis[(E)-octadec-9-enoxy]propyl N-(2-pyrrolidin-1-ylethyl)sulfamate Openeye Name: 2,3-bis[(E)-octadec-9-enoxy]propyl N-(2-pyrrolidin-1-ylethyl)sulfamate CAS Name: N-[2-(1-pyrrolidinyl)ethyl]sulfamic acid 2,3-bis[(E)-octadec-9-enoxy]propyl ester IUPAC Name: 2,3-bis[(E)-octadec-9-enoxy]propyl N-(2-pyrrolidin-1-ylethyl)sulfamate Traditional Name: N-(2-pyrrolidinoethyl)sulfamic acid 2,3-bis[(E)-octadec-9-enoxy]propyl ester Formula: C45H88N2O5S MolecularWeight: 769.25562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(COS(=O)(=O)NCCN1CCCC1)OCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(COS(=O)(=O)NCCN1CCCC1)OCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C45H88N2O5S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-41-50-43-45(44-52-53(48,49)46-37-40-47-38-33-34-39-47)51-42-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,45-46H,3-16,21-44H2,1-2H3/b19-17+,20-18+