(Z)-4-[bis[2-(octadecanoylamino)ethyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[bis[2-(octadecanoylamino)ethyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[bis[2-(octadecanoylamino)ethyl]amino]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[bis[2-(1-oxooctadecylamino)ethyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[bis[2-(octadecanoylamino)ethyl]amino]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[bis(2-stearamidoethyl)amino]-4-keto-but-2-enoic acid Formula: C44H83N3O5 MolecularWeight: 734.14692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCCCCCCCCCCCC)C(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCCCCCCCCCCCC)C(=O)/C=C\C(=O)O

InChI

InChI=1S/C44H83N3O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(48)45-37-39-47(43(50)35-36-44(51)52)40-38-46-42(49)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34,37-40H2,1-2H3,(H,45,48)(H,46,49)(H,51,52)/b36-35-