2,6-dibutyl-4-(3-isocyanato-2,2-dimethyl-propyl)phenol

Systemtic Name: 2,6-dibutyl-4-(3-isocyanato-2,2-dimethyl-propyl)phenol Openeye Name: 2,6-dibutyl-4-(3-isocyanato-2,2-dimethyl-propyl)phenol CAS Name: 2,6-dibutyl-4-(3-isocyanato-2,2-dimethylpropyl)phenol IUPAC Name: 2,6-dibutyl-4-(3-isocyanato-2,2-dimethylpropyl)phenol Traditional Name: 2,6-dibutyl-4-(3-isocyanato-2,2-dimethyl-propyl)phenol Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C1O)CCCC)CC(C)(C)CN=C=O

Isomeric SMILES

CCCCC1=CC(=CC(=C1O)CCCC)CC(C)(C)CN=C=O

InChI

InChI=1S/C20H31NO2/c1-5-7-9-17-11-16(13-20(3,4)14-21-15-22)12-18(19(17)23)10-8-6-2/h11-12,23H,5-10,13-14H2,1-4H3