(9E,28E)-19-azanylheptatriaconta-9,28-diene-18,20-dione; octadecanoate

Systemtic Name: (9E,28E)-19-azanylheptatriaconta-9,28-diene-18,20-dione; octadecanoate Openeye Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; octadecanoate CAS Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; octadecanoate IUPAC Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; octadecanoate Traditional Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; stearate Formula: C55H104NO4- MolecularWeight: 843.41856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)C(C(=O)CCCCCCCC=CCCCCCCCC)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)C(N)C(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C37H69NO2.C18H36O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(39)37(38)36(40)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h17-20,37H,3-16,21-34,38H2,1-2H3;2-17H2,1H3,(H,19,20)/p-1/b19-17+,20-18+;