6-[(E)-1-azanyl-2-oxidanyl-heptadec-3-enyl]pyran-2,5-dione

Systemtic Name: 6-[(E)-1-azanyl-2-oxidanyl-heptadec-3-enyl]pyran-2,5-dione Openeye Name: 6-[(E)-1-amino-2-hydroxy-heptadec-3-enyl]pyran-2,5-dione CAS Name: 6-[(E)-1-amino-2-hydroxyheptadec-3-enyl]pyran-2,5-dione IUPAC Name: 6-[(E)-1-amino-2-hydroxyheptadec-3-enyl]pyran-2,5-dione Traditional Name: 6-[(E)-1-amino-2-hydroxy-heptadec-3-enyl]pyran-2,5-quinone Formula: C22H37NO4 MolecularWeight: 379.53348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(C1C(=O)C=CC(=O)O1)N)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(C1C(=O)C=CC(=O)O1)N)O

InChI

InChI=1S/C22H37NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)21(23)22-19(25)16-17-20(26)27-22/h14-18,21-22,24H,2-13,23H2,1H3/b15-14+