hexyl (2E,4E)-6-azanyl-6-oxidanylidene-2,3-bis(2-oxidanylidenepropyl)hexa-2,4-dienoate

Systemtic Name: hexyl (2E,4E)-6-azanyl-6-oxidanylidene-2,3-bis(2-oxidanylidenepropyl)hexa-2,4-dienoate Openeye Name: hexyl (2E,4E)-2,3-diacetonyl-6-amino-6-oxo-hexa-2,4-dienoate CAS Name: (2E,4E)-6-amino-6-oxo-2,3-bis(2-oxopropyl)hexa-2,4-dienoic acid hexyl ester IUPAC Name: hexyl (2E,4E)-6-amino-6-oxo-2,3-bis(2-oxopropyl)hexa-2,4-dienoate Traditional Name: (2E,4E)-2,3-diacetonyl-6-amino-6-keto-hexa-2,4-dienoic acid hexyl ester Formula: C18H27NO5 MolecularWeight: 337.41068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(=C(CC(=O)C)C=CC(=O)N)CC(=O)C

Isomeric SMILES

CCCCCCOC(=O)/C(=C(\CC(=O)C)/C=C/C(=O)N)/CC(=O)C

InChI

InChI=1S/C18H27NO5/c1-4-5-6-7-10-24-18(23)16(12-14(3)21)15(11-13(2)20)8-9-17(19)22/h8-9H,4-7,10-12H2,1-3H3,(H2,19,22)/b9-8+,16-15-