4-methoxy-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-methoxy-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenyl-pyrazole-3-carboxamide Openeye Name: 4-methoxy-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-methoxy-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-methoxy-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenylpyrazole-3-carboxamide Traditional Name: N-[1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]-4-methoxy-1-phenyl-pyrazole-3-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)C3=NN(C=C3OC)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)C3=NN(C=C3OC)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O4/c1-13(14-8-9-17-16(10-14)23-19(26)12-29-17)22-21(27)20-18(28-2)11-25(24-20)15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H,22,27)(H,23,26)