1-butan-2-yl-4-(1-isocyanoethyl)benzene

Systemtic Name: 1-butan-2-yl-4-(1-isocyanoethyl)benzene Openeye Name: 1-(1-isocyanoethyl)-4-sec-butyl-benzene CAS Name: 1-butan-2-yl-4-(1-isocyanoethyl)benzene IUPAC Name: 1-butan-2-yl-4-(1-isocyanoethyl)benzene Traditional Name: 1-(1-isocyanoethyl)-4-sec-butyl-benzene Formula: C13H17N MolecularWeight: 187.28078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C)[N+]#[C-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C)[N+]#[C-]

InChI

InChI=1S/C13H17N/c1-5-10(2)12-6-8-13(9-7-12)11(3)14-4/h6-11H,5H2,1-3H3