N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]-2-bromanyl-aniline

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]-2-bromanyl-aniline Openeye Name: N-[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-2-bromo-aniline CAS Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]-2-bromoaniline IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]-2-bromoaniline Traditional Name: [3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-(2-bromophenyl)amine Formula: C17H18BrNO2 MolecularWeight: 348.23432

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)NC3=CC=CC=C3Br

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)NC3=CC=CC=C3Br

InChI

InChI=1S/C17H18BrNO2/c1-12(19-15-5-3-2-4-14(15)18)6-7-13-8-9-16-17(10-13)21-11-20-16/h2-5,8-10,12,19H,6-7,11H2,1H3