N-[(4-methoxy-2-methyl-5-propan-2-yl-phenyl)methyl]-4H-1,3-benzodioxine-4-carboxamide

Systemtic Name: N-[(4-methoxy-2-methyl-5-propan-2-yl-phenyl)methyl]-4H-1,3-benzodioxine-4-carboxamide Openeye Name: N-[(5-isopropyl-4-methoxy-2-methyl-phenyl)methyl]-4H-1,3-benzodioxine-4-carboxamide CAS Name: N-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]-4H-1,3-benzodioxin-4-carboxamide IUPAC Name: N-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]-4H-1,3-benzodioxine-4-carboxamide Traditional Name: N-(5-isopropyl-4-methoxy-2-methyl-benzyl)-4H-1,3-benzodioxin-4-carboxamide Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CNC(=O)C2C3=CC=CC=C3OCO2)C(C)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CNC(=O)C2C3=CC=CC=C3OCO2)C(C)C)OC

InChI

InChI=1S/C21H25NO4/c1-13(2)17-10-15(14(3)9-19(17)24-4)11-22-21(23)20-16-7-5-6-8-18(16)25-12-26-20/h5-10,13,20H,11-12H2,1-4H3,(H,22,23)