1-[(E)-but-2-en-2-yl]-3-(1-isocyanatoethyl)benzene

Systemtic Name: 1-[(E)-but-2-en-2-yl]-3-(1-isocyanatoethyl)benzene Openeye Name: 1-(1-isocyanatoethyl)-3-[(E)-1-methylprop-1-enyl]benzene CAS Name: 1-[(E)-but-2-en-2-yl]-3-(1-isocyanatoethyl)benzene IUPAC Name: 1-[(E)-but-2-en-2-yl]-3-(1-isocyanatoethyl)benzene Traditional Name: 1-(1-isocyanatoethyl)-3-[(E)-1-methylprop-1-enyl]benzene Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C(\C)/C1=CC(=CC=C1)C(C)N=C=O

InChI

InChI=1S/C13H15NO/c1-4-10(2)12-6-5-7-13(8-12)11(3)14-9-15/h4-8,11H,1-3H3/b10-4+