3-isocyanato-1-(2-methylprop-2-enyl)indole

Systemtic Name: 3-isocyanato-1-(2-methylprop-2-enyl)indole Openeye Name: 3-isocyanato-1-(2-methylallyl)indole CAS Name: 3-isocyanato-1-(2-methylprop-2-enyl)indole IUPAC Name: 3-isocyanato-1-(2-methylprop-2-enyl)indole Traditional Name: 3-isocyanato-1-(2-methylallyl)indole Formula: C13H12N2O MolecularWeight: 212.24718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C=C(C2=CC=CC=C21)N=C=O

Isomeric SMILES

CC(=C)CN1C=C(C2=CC=CC=C21)N=C=O

InChI

InChI=1S/C13H12N2O/c1-10(2)7-15-8-12(14-9-16)11-5-3-4-6-13(11)15/h3-6,8H,1,7H2,2H3