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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(OC1=O)CCCCCN(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCCCC1C(OC1=O)CCCCCN(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

InChI

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