5-(3-hexyl-4-oxidanylidene-oxetan-2-yl)pentyl N-phenylcarbamate

Systemtic Name: 5-(3-hexyl-4-oxidanylidene-oxetan-2-yl)pentyl N-phenylcarbamate Openeye Name: 5-(3-hexyl-4-oxo-oxetan-2-yl)pentyl N-phenylcarbamate CAS Name: N-phenylcarbamic acid 5-(3-hexyl-4-oxo-2-oxetanyl)pentyl ester IUPAC Name: 5-(3-hexyl-4-oxooxetan-2-yl)pentyl N-phenylcarbamate Traditional Name: N-phenylcarbamic acid 5-(3-hexyl-4-keto-oxetan-2-yl)pentyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(OC1=O)CCCCCOC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCCCC1C(OC1=O)CCCCCOC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H31NO4/c1-2-3-4-9-14-18-19(26-20(18)23)15-10-6-11-16-25-21(24)22-17-12-7-5-8-13-17/h5,7-8,12-13,18-19H,2-4,6,9-11,14-16H2,1H3,(H,22,24)