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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(phenylcarbamoylamino)butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(phenylcarbamoylamino)butanamide CAS Name: 2-[[anilino(oxo)methyl]amino]-N-(1,3-benzodioxol-5-ylmethyl)-3-methylbutanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(phenylcarbamoylamino)butanamide Traditional Name: 3-methyl-2-(phenylcarbamoylamino)-N-piperonyl-butyramide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O4/c1-13(2)18(23-20(25)22-15-6-4-3-5-7-15)19(24)21-11-14-8-9-16-17(10-14)27-12-26-16/h3-10,13,18H,11-12H2,1-2H3,(H,21,24)(H2,22,23,25)