2-(azepan-1-yl)ethyl 6-isocyanatohexanoate

Systemtic Name: 2-(azepan-1-yl)ethyl 6-isocyanatohexanoate Openeye Name: 2-(azepan-1-yl)ethyl 6-isocyanatohexanoate CAS Name: 6-isocyanatohexanoic acid 2-(1-azepanyl)ethyl ester IUPAC Name: 2-(azepan-1-yl)ethyl 6-isocyanatohexanoate Traditional Name: 6-isocyanatohexanoic acid 2-(azepan-1-yl)ethyl ester Formula: C15H26N2O3 MolecularWeight: 282.37854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC(=O)CCCCCN=C=O

Isomeric SMILES

C1CCCN(CC1)CCOC(=O)CCCCCN=C=O

InChI

InChI=1S/C15H26N2O3/c18-14-16-9-5-3-4-8-15(19)20-13-12-17-10-6-1-2-7-11-17/h1-13H2