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

Systemtic Name: N-methyl-4-[3-(1-phenylpyrazol-4-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-methyl-4-[3-(1-phenylpyrazol-4-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-methyl-4-[1-oxo-3-(1-phenyl-4-pyrazolyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-methyl-4-[3-(1-phenylpyrazol-4-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-methyl-4-[3-(1-phenylpyrazol-4-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H22N4O3 MolecularWeight: 390.43508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O3/c1-23-22(28)20-15-25(18-9-5-6-10-19(18)29-20)21(27)12-11-16-13-24-26(14-16)17-7-3-2-4-8-17/h2-10,13-14,20H,11-12,15H2,1H3,(H,23,28)