1-[1-[(E)-octadec-9-enoyl]oxyethyl-(phenylcarbonyl)amino]ethyl (E)-octadec-9-enoate

Systemtic Name: 1-[1-[(E)-octadec-9-enoyl]oxyethyl-(phenylcarbonyl)amino]ethyl (E)-octadec-9-enoate Openeye Name: 1-[benzoyl-[1-[(E)-octadec-9-enoyl]oxyethyl]amino]ethyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid 1-[benzoyl-[1-[(E)-1-oxooctadec-9-enoxy]ethyl]amino]ethyl ester IUPAC Name: 1-[benzoyl-[1-[(E)-octadec-9-enoyl]oxyethyl]amino]ethyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 1-[benzoyl-[1-[(E)-octadec-9-enoyl]oxyethyl]amino]ethyl ester Formula: C47H79NO5 MolecularWeight: 738.13386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C)N(C(C)OC(=O)CCCCCCCC=CCCCCCCCC)C(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(N(C(=O)C1=CC=CC=C1)C(OC(=O)CCCCCCC/C=C/CCCCCCCC)C)C

InChI

InChI=1S/C47H79NO5/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36-40-45(49)52-42(3)48(47(51)44-38-34-33-35-39-44)43(4)53-46(50)41-37-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h19-22,33-35,38-39,42-43H,5-18,23-32,36-37,40-41H2,1-4H3/b21-19+,22-20+