(2S)-2-[(1Z,4Z)-hepta-1,4-dienyl]-1,5,9-triazacyclotridecan-4-one

Systemtic Name: (2S)-2-[(1Z,4Z)-hepta-1,4-dienyl]-1,5,9-triazacyclotridecan-4-one Openeye Name: (2S)-2-[(1Z,4Z)-hepta-1,4-dienyl]-1,5,9-triazacyclotridecan-4-one CAS Name: (2S)-2-[(1Z,4Z)-hepta-1,4-dienyl]-1,5,9-triazacyclotridecan-4-one IUPAC Name: (2S)-2-[(1Z,4Z)-hepta-1,4-dienyl]-1,5,9-triazacyclotridecan-4-one Traditional Name: (2S)-2-[(1Z,4Z)-hepta-1,4-dienyl]-1,5,9-triazacyclotridecan-4-one Formula: C17H31N3O MolecularWeight: 293.44754

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CC1CC(=O)NCCCNCCCCN1

Isomeric SMILES

CC/C=C\C/C=C\[C@@H]1CC(=O)NCCCNCCCCN1

InChI

InChI=1S/C17H31N3O/c1-2-3-4-5-6-10-16-15-17(21)20-14-9-12-18-11-7-8-13-19-16/h3-4,6,10,16,18-19H,2,5,7-9,11-15H2,1H3,(H,20,21)/b4-3-,10-6-/t16-/m1/s1