6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexyl (E)-3-azanylbut-2-enoate

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexyl (E)-3-azanylbut-2-enoate Openeye Name: 6-(1,3-dioxoisoindolin-2-yl)hexyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 6-(1,3-dioxo-2-isoindolyl)hexyl ester IUPAC Name: 6-(1,3-dioxoisoindol-2-yl)hexyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 6-phthalimidohexyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCCCCCCN1C(=O)C2=CC=CC=C2C1=O)N

Isomeric SMILES

C/C(=C\C(=O)OCCCCCCN1C(=O)C2=CC=CC=C2C1=O)/N

InChI

InChI=1S/C18H22N2O4/c1-13(19)12-16(21)24-11-7-3-2-6-10-20-17(22)14-8-4-5-9-15(14)18(20)23/h4-5,8-9,12H,2-3,6-7,10-11,19H2,1H3/b13-12+