ethyl N-[3-oxidanyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-7-yl]carbamate

Systemtic Name: ethyl N-[3-oxidanyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-7-yl]carbamate Openeye Name: ethyl N-[3-hydroxy-3-[(isopropylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-7-yl]carbamate CAS Name: N-[3-hydroxy-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-hydroxy-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-7-yl]carbamate Traditional Name: N-[3-hydroxy-3-[(isopropylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-7-yl]carbamic acid ethyl ester Formula: C16H24N2O5 MolecularWeight: 324.37216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)OCC(CO2)(CNC(C)C)O

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)OCC(CO2)(CNC(C)C)O

InChI

InChI=1S/C16H24N2O5/c1-4-21-15(19)18-12-5-6-13-14(7-12)23-10-16(20,9-22-13)8-17-11(2)3/h5-7,11,17,20H,4,8-10H2,1-3H3,(H,18,19)