[2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C16H21NO5 MolecularWeight: 307.34164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)CCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)CCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H21NO5/c1-16(2,3)17-14(18)9-20-15(19)7-5-11-4-6-12-13(8-11)22-10-21-12/h4,6,8H,5,7,9-10H2,1-3H3,(H,17,18)