2-pyrrolidin-1-ylethyl 6-isocyanatohexanoate

Systemtic Name: 2-pyrrolidin-1-ylethyl 6-isocyanatohexanoate Openeye Name: 2-pyrrolidin-1-ylethyl 6-isocyanatohexanoate CAS Name: 6-isocyanatohexanoic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl 6-isocyanatohexanoate Traditional Name: 6-isocyanatohexanoic acid 2-pyrrolidinoethyl ester Formula: C13H22N2O3 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC(=O)CCCCCN=C=O

Isomeric SMILES

C1CCN(C1)CCOC(=O)CCCCCN=C=O

InChI

InChI=1S/C13H22N2O3/c16-12-14-7-3-1-2-6-13(17)18-11-10-15-8-4-5-9-15/h1-11H2