3-isocyanatopropyl (2E)-penta-2,4-dienoate

Systemtic Name: 3-isocyanatopropyl (2E)-penta-2,4-dienoate Openeye Name: 3-isocyanatopropyl (2E)-penta-2,4-dienoate CAS Name: (2E)-penta-2,4-dienoic acid 3-isocyanatopropyl ester IUPAC Name: 3-isocyanatopropyl (2E)-penta-2,4-dienoate Traditional Name: (2E)-penta-2,4-dienoic acid 3-isocyanatopropyl ester Formula: C9H11NO3 MolecularWeight: 181.18854

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=CC(=O)OCCCN=C=O

Isomeric SMILES

C=C/C=C/C(=O)OCCCN=C=O

InChI

InChI=1S/C9H11NO3/c1-2-3-5-9(12)13-7-4-6-10-8-11/h2-3,5H,1,4,6-7H2/b5-3+