hepta-2,3,4,5,6-pentaen-2-yl 4-[bis(2-oxidanylidenepropyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: hepta-2,3,4,5,6-pentaen-2-yl 4-[bis(2-oxidanylidenepropyl)amino]-4-oxidanylidene-butanoate Openeye Name: 1-methylhexa-1,2,3,4,5-pentaenyl 4-(diacetonylamino)-4-oxo-butanoate CAS Name: 4-[bis(2-oxopropyl)amino]-4-oxobutanoic acid hepta-2,3,4,5,6-pentaen-2-yl ester IUPAC Name: hepta-2,3,4,5,6-pentaen-2-yl 4-[bis(2-oxopropyl)amino]-4-oxobutanoate Traditional Name: 4-(diacetonylamino)-4-keto-butyric acid 1-methylhexa-1,2,3,4,5-pentaenyl ester Formula: C17H19NO5 MolecularWeight: 317.33646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO5/c1-5-6-7-8-15(4)23-17(22)10-9-16(21)18(11-13(2)19)12-14(3)20/h1,9-12H2,2-4H3