methyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-4-methyl-pentanoate

Systemtic Name: methyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-4-methyl-pentanoate Openeye Name: methyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-4-methyl-pentanoate CAS Name: 2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-4-methylpentanoate Traditional Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-4-methyl-valeric acid methyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)NC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C15H20N2O5/c1-9(2)6-11(14(18)20-3)17-15(19)16-10-4-5-12-13(7-10)22-8-21-12/h4-5,7,9,11H,6,8H2,1-3H3,(H2,16,17,19)