3-(1,3-benzodioxol-5-yl)-N-[1-(3-bromophenyl)ethyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[1-(3-bromophenyl)ethyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[1-(3-bromophenyl)ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[1-(3-bromophenyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[1-(3-bromophenyl)ethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[1-(3-bromophenyl)ethyl]propionamide Formula: C18H18BrNO3 MolecularWeight: 376.24442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18BrNO3/c1-12(14-3-2-4-15(19)10-14)20-18(21)8-6-13-5-7-16-17(9-13)23-11-22-16/h2-5,7,9-10,12H,6,8,11H2,1H3,(H,20,21)