3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-methylphenyl)prop-2-en-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-methylphenyl)prop-2-en-1-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(p-tolyl)prop-2-en-1-one CAS Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-methylphenyl)-2-propen-1-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-methylphenyl)prop-2-en-1-one Traditional Name: 3-(piperonylamino)-1-(p-tolyl)prop-2-en-1-one Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CNCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C=CNCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H17NO3/c1-13-2-5-15(6-3-13)16(20)8-9-19-11-14-4-7-17-18(10-14)22-12-21-17/h2-10,19H,11-12H2,1H3