1-methyl-2-[(4E,6E)-2-methyl-1-oxidanyl-octa-4,6-dienyl]-1-azacyclotridecan-3-one

Systemtic Name: 1-methyl-2-[(4E,6E)-2-methyl-1-oxidanyl-octa-4,6-dienyl]-1-azacyclotridecan-3-one Openeye Name: 2-[(4E,6E)-1-hydroxy-2-methyl-octa-4,6-dienyl]-1-methyl-azacyclotridecan-3-one CAS Name: 2-[(4E,6E)-1-hydroxy-2-methylocta-4,6-dienyl]-1-methyl-azacyclotridecan-3-one IUPAC Name: 2-[(4E,6E)-1-hydroxy-2-methylocta-4,6-dienyl]-1-methyl-azacyclotridecan-3-one Traditional Name: 2-[(4E,6E)-1-hydroxy-2-methyl-octa-4,6-dienyl]-1-methyl-azacyclotridecan-3-one Formula: C22H39NO2 MolecularWeight: 349.55056

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CCC(C)C(C1C(=O)CCCCCCCCCCN1C)O

Isomeric SMILES

C/C=C/C=C/CC(C)C(C1C(=O)CCCCCCCCCCN1C)O

InChI

InChI=1S/C22H39NO2/c1-4-5-6-13-16-19(2)22(25)21-20(24)17-14-11-9-7-8-10-12-15-18-23(21)3/h4-6,13,19,21-22,25H,7-12,14-18H2,1-3H3/b5-4+,13-6+