(E)-6-azanyl-2-methylidene-6-oxidanylidene-3,3-bis(2-oxidanylidenepropyl)hex-4-enoic acid; butyl (E)-2-methylidene-4-phenyl-but-3-enoate

Systemtic Name: (E)-6-azanyl-2-methylidene-6-oxidanylidene-3,3-bis(2-oxidanylidenepropyl)hex-4-enoic acid; butyl (E)-2-methylidene-4-phenyl-but-3-enoate Openeye Name: butyl (E)-2-methylene-4-phenyl-but-3-enoate; (E)-3,3-diacetonyl-6-amino-2-methylene-6-oxo-hex-4-enoic acid CAS Name: (E)-6-amino-2-methylene-6-oxo-3,3-bis(2-oxopropyl)-4-hexenoic acid; (E)-2-methylene-4-phenyl-3-butenoic acid butyl ester IUPAC Name: (E)-6-amino-2-methylidene-6-oxo-3,3-bis(2-oxopropyl)hex-4-enoic acid; butyl (E)-2-methylidene-4-phenylbut-3-enoate Traditional Name: (E)-3,3-diacetonyl-6-amino-6-keto-2-methylene-hex-4-enoic acid; (E)-2-methylene-4-phenyl-but-3-enoic acid butyl ester Formula: C28H35NO7 MolecularWeight: 497.58

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=C)C=CC1=CC=CC=C1.CC(=O)CC(CC(=O)C)(C=CC(=O)N)C(=C)C(=O)O

Isomeric SMILES

CCCCOC(=O)C(=C)/C=C/C1=CC=CC=C1.CC(=O)CC(CC(=O)C)(/C=C/C(=O)N)C(=C)C(=O)O

InChI

InChI=1S/C15H18O2.C13H17NO5/c1-3-4-12-17-15(16)13(2)10-11-14-8-6-5-7-9-14;1-8(15)6-13(7-9(2)16,5-4-11(14)17)10(3)12(18)19/h5-11H,2-4,12H2,1H3;4-5H,3,6-7H2,1-2H3,(H2,14,17)(H,18,19)/b11-10+;5-4+