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

Systemtic Name: (9E,28E)-19-azanylheptatriaconta-9,28-diene-18,20-dione; (E)-octadec-9-enoate Openeye Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; (E)-octadec-9-enoate CAS Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; (E)-9-octadecenoate IUPAC Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; (E)-octadec-9-enoate Traditional Name: (9E,28E)-19-aminoheptatriaconta-9,28-diene-18,20-dione; (E)-octadec-9-enoate Formula: C55H102NO4- MolecularWeight: 841.40268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H69NO2.C18H34O2/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;9-10H,2-8,11-17H2,1H3,(H,19,20)/p-1/b19-17+,20-18+;10-9+