7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-amine

Systemtic Name: 7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-amine Openeye Name: 7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-amine CAS Name: 7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-amine IUPAC Name: 7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-amine Traditional Name: [7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-yl]amine Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

COCCC#CC1=C2C(=C(C=C1)N)OCO2

Isomeric SMILES

COCCC#CC1=C2C(=C(C=C1)N)OCO2

InChI

InChI=1S/C12H13NO3/c1-14-7-3-2-4-9-5-6-10(13)12-11(9)15-8-16-12/h5-6H,3,7-8,13H2,1H3