4-[2-[2-[2-(1,3-benzodioxol-5-yl)ethanoyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[2-[2-(1,3-benzodioxol-5-yl)ethanoyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 4-[2-[2-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-1-pyrazolidinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-2-keto-ethyl]-1,4-benzoxazin-3-one Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)CN2C(=O)COC3=CC=CC=C32)C(=O)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(N(C1)C(=O)CN2C(=O)COC3=CC=CC=C32)C(=O)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N3O6/c26-20(11-15-6-7-18-19(10-15)31-14-30-18)24-8-3-9-25(24)21(27)12-23-16-4-1-2-5-17(16)29-13-22(23)28/h1-2,4-7,10H,3,8-9,11-14H2