(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromanyl-3-methyl-phenyl)amino]propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromanyl-3-methyl-phenyl)amino]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromo-3-methyl-anilino)propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromo-3-methylanilino)propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromo-3-methylanilino)propanamide Traditional Name: (2R)-2-(4-bromo-3-methyl-anilino)-N-piperonyl-propionamide Formula: C18H19BrN2O3 MolecularWeight: 391.25906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(C)C(=O)NCC2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N[C@H](C)C(=O)NCC2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C18H19BrN2O3/c1-11-7-14(4-5-15(11)19)21-12(2)18(22)20-9-13-3-6-16-17(8-13)24-10-23-16/h3-8,12,21H,9-10H2,1-2H3,(H,20,22)/t12-/m1/s1