N-[3-(hexadecanoylamino)-6-oxidanylidene-5H-phenanthridin-8-yl]hexadecanamide

Systemtic Name: N-[3-(hexadecanoylamino)-6-oxidanylidene-5H-phenanthridin-8-yl]hexadecanamide Openeye Name: N-[3-(hexadecanoylamino)-6-oxo-5H-phenanthridin-8-yl]hexadecanamide CAS Name: N-[6-oxo-3-(1-oxohexadecylamino)-5H-phenanthridin-8-yl]hexadecanamide IUPAC Name: N-[3-(hexadecanoylamino)-6-oxo-5H-phenanthridin-8-yl]hexadecanamide Traditional Name: N-(6-keto-3-palmitamido-5H-phenanthridin-8-yl)palmitamide Formula: C45H71N3O3 MolecularWeight: 702.06354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC2=C(C=C1)C3=C(C=C(C=C3)NC(=O)CCCCCCCCCCCCCCC)NC2=O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC2=C(C=C1)C3=C(C=C(C=C3)NC(=O)CCCCCCCCCCCCCCC)NC2=O

InChI

InChI=1S/C45H71N3O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-43(49)46-37-31-33-39-40-34-32-38(36-42(40)48-45(51)41(39)35-37)47-44(50)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-36H,3-30H2,1-2H3,(H,46,49)(H,47,50)(H,48,51)