5-(3-hexyl-4-oxidanylidene-oxetan-2-yl)pentyl-(2-phenoxyphenyl)carbamic acid

Systemtic Name: 5-(3-hexyl-4-oxidanylidene-oxetan-2-yl)pentyl-(2-phenoxyphenyl)carbamic acid Openeye Name: 5-(3-hexyl-4-oxo-oxetan-2-yl)pentyl-(2-phenoxyphenyl)carbamic acid CAS Name: 5-(3-hexyl-4-oxo-2-oxetanyl)pentyl-(2-phenoxyphenyl)carbamic acid IUPAC Name: 5-(3-hexyl-4-oxooxetan-2-yl)pentyl-(2-phenoxyphenyl)carbamic acid Traditional Name: 5-(3-hexyl-4-keto-oxetan-2-yl)pentyl-(2-phenoxyphenyl)carbamic acid Formula: C27H35NO5 MolecularWeight: 453.5705

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(OC1=O)CCCCCN(C2=CC=CC=C2OC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCCCC1C(OC1=O)CCCCCN(C2=CC=CC=C2OC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H35NO5/c1-2-3-4-9-16-22-24(33-26(22)29)18-10-6-13-20-28(27(30)31)23-17-11-12-19-25(23)32-21-14-7-5-8-15-21/h5,7-8,11-12,14-15,17,19,22,24H,2-4,6,9-10,13,16,18,20H2,1H3,(H,30,31)