1-azanylbutan-2-yl (2E,4E)-6-azanyl-6-oxidanylidene-2,3-bis(2-oxidanylidenepropyl)hexa-2,4-dienoate

Systemtic Name: 1-azanylbutan-2-yl (2E,4E)-6-azanyl-6-oxidanylidene-2,3-bis(2-oxidanylidenepropyl)hexa-2,4-dienoate Openeye Name: 1-(aminomethyl)propyl (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 1-aminobutan-2-yl ester IUPAC Name: 1-aminobutan-2-yl (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 1-(aminomethyl)propyl ester Formula: C16H24N2O5 MolecularWeight: 324.37216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN)OC(=O)C(=C(CC(=O)C)C=CC(=O)N)CC(=O)C

Isomeric SMILES

CCC(CN)OC(=O)/C(=C(\CC(=O)C)/C=C/C(=O)N)/CC(=O)C

InChI

InChI=1S/C16H24N2O5/c1-4-13(9-17)23-16(22)14(8-11(3)20)12(7-10(2)19)5-6-15(18)21/h5-6,13H,4,7-9,17H2,1-3H3,(H2,18,21)/b6-5+,14-12-