N-methyl-3-oxidanylidene-N-[(1-phenylpyrazol-4-yl)methyl]-4H-1,4-benzoxazine-7-carboxamide

Systemtic Name: N-methyl-3-oxidanylidene-N-[(1-phenylpyrazol-4-yl)methyl]-4H-1,4-benzoxazine-7-carboxamide Openeye Name: N-methyl-3-oxo-N-[(1-phenylpyrazol-4-yl)methyl]-4H-1,4-benzoxazine-7-carboxamide CAS Name: N-methyl-3-oxo-N-[(1-phenyl-4-pyrazolyl)methyl]-4H-1,4-benzoxazine-7-carboxamide IUPAC Name: N-methyl-3-oxo-N-[(1-phenylpyrazol-4-yl)methyl]-4H-1,4-benzoxazine-7-carboxamide Traditional Name: 3-keto-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-4H-1,4-benzoxazine-7-carboxamide Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)NC(=O)CO4

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)NC(=O)CO4

InChI

InChI=1S/C20H18N4O3/c1-23(11-14-10-21-24(12-14)16-5-3-2-4-6-16)20(26)15-7-8-17-18(9-15)27-13-19(25)22-17/h2-10,12H,11,13H2,1H3,(H,22,25)