N-methyl-4-[2-(1-phenylpyrazol-4-yl)ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-methyl-4-[2-(1-phenylpyrazol-4-yl)ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-methyl-4-[2-(1-phenylpyrazol-4-yl)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-methyl-4-[1-oxo-2-(1-phenyl-4-pyrazolyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-methyl-4-[2-(1-phenylpyrazol-4-yl)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-methyl-4-[2-(1-phenylpyrazol-4-yl)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3/c1-22-21(27)19-14-24(17-9-5-6-10-18(17)28-19)20(26)11-15-12-23-25(13-15)16-7-3-2-4-8-16/h2-10,12-13,19H,11,14H2,1H3,(H,22,27)