1-(1-isocyanato-3-methyl-butyl)-2,3-dimethyl-benzene

Systemtic Name: 1-(1-isocyanato-3-methyl-butyl)-2,3-dimethyl-benzene Openeye Name: 1-(1-isocyanato-3-methyl-butyl)-2,3-dimethyl-benzene CAS Name: 1-(1-isocyanato-3-methylbutyl)-2,3-dimethylbenzene IUPAC Name: 1-(1-isocyanato-3-methylbutyl)-2,3-dimethylbenzene Traditional Name: 1-(1-isocyanato-3-methyl-butyl)-2,3-dimethyl-benzene Formula: C14H19NO MolecularWeight: 217.30676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(CC(C)C)N=C=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(CC(C)C)N=C=O)C

InChI

InChI=1S/C14H19NO/c1-10(2)8-14(15-9-16)13-7-5-6-11(3)12(13)4/h5-7,10,14H,8H2,1-4H3