1-(1,3-benzodioxol-5-yl)-3-[[4-[(2S)-butan-2-yl]phenyl]amino]propan-1-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-[(2S)-butan-2-yl]phenyl]amino]propan-1-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[4-[(1S)-1-methylpropyl]anilino]propan-1-one CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-[(2S)-butan-2-yl]anilino]-1-propanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[4-[(2S)-butan-2-yl]anilino]propan-1-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[4-[(1S)-1-methylpropyl]anilino]propan-1-one Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NCCC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NCCC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H23NO3/c1-3-14(2)15-4-7-17(8-5-15)21-11-10-18(22)16-6-9-19-20(12-16)24-13-23-19/h4-9,12,14,21H,3,10-11,13H2,1-2H3/t14-/m0/s1