N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(4-nitrophenyl)butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(4-nitrophenyl)butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(4-nitrophenyl)butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(4-nitrophenyl)butanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(4-nitrophenyl)butanamide Traditional Name: 3-methyl-2-(4-nitrophenyl)-N-piperonyl-butyramide Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H20N2O5/c1-12(2)18(14-4-6-15(7-5-14)21(23)24)19(22)20-10-13-3-8-16-17(9-13)26-11-25-16/h3-9,12,18H,10-11H2,1-2H3,(H,20,22)