N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-2-(phenylcarbamoylamino)butanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-2-(phenylcarbamoylamino)butanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-2-(phenylcarbamoylamino)butanamide CAS Name: 2-[[anilino(oxo)methyl]amino]-N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-methylbutanamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-2-(phenylcarbamoylamino)butanamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-2-(phenylcarbamoylamino)butyramide Formula: C21H25N3O4 MolecularWeight: 383.4409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-13(2)19(24-21(26)23-16-7-5-4-6-8-16)20(25)22-14(3)15-9-10-17-18(11-15)28-12-27-17/h4-11,13-14,19H,12H2,1-3H3,(H,22,25)(H2,23,24,26)