10-isocyanatodec-1-ene; isocyanatoethane; 1-isocyanatononane; 3-isocyanatopropylbenzene

Systemtic Name: 10-isocyanatodec-1-ene; isocyanatoethane; 1-isocyanatononane; 3-isocyanatopropylbenzene Openeye Name: 10-isocyanatodec-1-ene; isocyanatoethane; 1-isocyanatononane; 3-isocyanatopropylbenzene CAS Name: 10-isocyanato-1-decene; isocyanatoethane; 1-isocyanatononane; 3-isocyanatopropylbenzene IUPAC Name: 10-isocyanatodec-1-ene; isocyanatoethane; 1-isocyanatononane; 3-isocyanatopropylbenzene Traditional Name: 10-isocyanatodec-1-ene; isocyanatoethane; 1-isocyanatononane; 3-isocyanatopropylbenzene Formula: C34H54N4O4 MolecularWeight: 582.81696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN=C=O.CCN=C=O.C=CCCCCCCCCN=C=O.C1=CC=C(C=C1)CCCN=C=O

Isomeric SMILES

CCCCCCCCCN=C=O.CCN=C=O.C=CCCCCCCCCN=C=O.C1=CC=C(C=C1)CCCN=C=O

InChI

InChI=1S/C11H19NO.C10H11NO.C10H19NO.C3H5NO/c1-2-3-4-5-6-7-8-9-10-12-11-13;12-9-11-8-4-7-10-5-2-1-3-6-10;1-2-3-4-5-6-7-8-9-11-10-12;1-2-4-3-5/h2H,1,3-10H2;1-3,5-6H,4,7-8H2;2-9H2,1H3;2H2,1H3