3-heptadecyl-5-(pentylamino)cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 3-heptadecyl-5-(pentylamino)cyclohexa-3,5-diene-1,2-dione Openeye Name: 3-heptadecyl-5-(pentylamino)-1,2-benzoquinone CAS Name: 3-heptadecyl-5-(pentylamino)cyclohexa-3,5-diene-1,2-dione IUPAC Name: 3-heptadecyl-5-(pentylamino)cyclohexa-3,5-diene-1,2-dione Traditional Name: 5-(amylamino)-3-heptadecyl-o-benzoquinone Formula: C28H49NO2 MolecularWeight: 431.69416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=CC(=CC(=O)C1=O)NCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=CC(=CC(=O)C1=O)NCCCCC

InChI

InChI=1S/C28H49NO2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-23-26(24-27(30)28(25)31)29-22-20-6-4-2/h23-24,29H,3-22H2,1-2H3