4-(3-hexyl-4-oxidanylidene-oxetan-2-yl)butyl N-(phenylmethyl)carbamate

Systemtic Name: 4-(3-hexyl-4-oxidanylidene-oxetan-2-yl)butyl N-(phenylmethyl)carbamate Openeye Name: 4-(3-hexyl-4-oxo-oxetan-2-yl)butyl N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid 4-(3-hexyl-4-oxo-2-oxetanyl)butyl ester IUPAC Name: 4-(3-hexyl-4-oxooxetan-2-yl)butyl N-benzylcarbamate Traditional Name: N-benzylcarbamic acid 4-(3-hexyl-4-keto-oxetan-2-yl)butyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(OC1=O)CCCCOC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCCCCC1C(OC1=O)CCCCOC(=O)NCC2=CC=CC=C2

InChI

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