(2R)-4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-[2-keto-2-(piperonylamino)ethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CNC(=O)[C@H]1CN(C2=CC=CC=C2O1)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O5/c1-21-20(25)18-10-23(14-4-2-3-5-15(14)28-18)11-19(24)22-9-13-6-7-16-17(8-13)27-12-26-16/h2-8,18H,9-12H2,1H3,(H,21,25)(H,22,24)/t18-/m1/s1