4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl (E)-3-azanylbut-2-enoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl (E)-3-azanylbut-2-enoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 4-phthalimidobutyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCCCCN1C(=O)C2=CC=CC=C2C1=O)N

Isomeric SMILES

C/C(=C\C(=O)OCCCCN1C(=O)C2=CC=CC=C2C1=O)/N

InChI

InChI=1S/C16H18N2O4/c1-11(17)10-14(19)22-9-5-4-8-18-15(20)12-6-2-3-7-13(12)16(18)21/h2-3,6-7,10H,4-5,8-9,17H2,1H3/b11-10+