4-dodecyl-2-isocyanato-1-methyl-benzene

Systemtic Name: 4-dodecyl-2-isocyanato-1-methyl-benzene Openeye Name: 4-dodecyl-2-isocyanato-1-methyl-benzene CAS Name: 4-dodecyl-2-isocyanato-1-methylbenzene IUPAC Name: 4-dodecyl-2-isocyanato-1-methylbenzene Traditional Name: 2-isocyanato-4-lauryl-1-methyl-benzene Formula: C20H31NO MolecularWeight: 301.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=C(C=C1)C)N=C=O

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=C(C=C1)C)N=C=O

InChI

InChI=1S/C20H31NO/c1-3-4-5-6-7-8-9-10-11-12-13-19-15-14-18(2)20(16-19)21-17-22/h14-16H,3-13H2,1-2H3