3-(1,3-benzodioxol-5-ylmethylamino)-1-(3-methoxyphenyl)but-2-en-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(3-methoxyphenyl)but-2-en-1-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(3-methoxyphenyl)but-2-en-1-one CAS Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(3-methoxyphenyl)-2-buten-1-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-(3-methoxyphenyl)but-2-en-1-one Traditional Name: 1-(3-methoxyphenyl)-3-(piperonylamino)but-2-en-1-one Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CC(=CC=C1)OC)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=CC(=O)C1=CC(=CC=C1)OC)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H19NO4/c1-13(8-17(21)15-4-3-5-16(10-15)22-2)20-11-14-6-7-18-19(9-14)24-12-23-18/h3-10,20H,11-12H2,1-2H3