6-(3,5-dimethylpyrazol-1-yl)carbonyl-2-ethyl-4-(phenylmethyl)-1,4-benzoxazin-3-one

Systemtic Name: 6-(3,5-dimethylpyrazol-1-yl)carbonyl-2-ethyl-4-(phenylmethyl)-1,4-benzoxazin-3-one Openeye Name: 4-benzyl-6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-1,4-benzoxazin-3-one CAS Name: 6-[(3,5-dimethyl-1-pyrazolyl)-oxomethyl]-2-ethyl-4-(phenylmethyl)-1,4-benzoxazin-3-one IUPAC Name: 4-benzyl-6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-1,4-benzoxazin-3-one Traditional Name: 4-benzyl-6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-1,4-benzoxazin-3-one Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3C(=CC(=N3)C)C)CC4=CC=CC=C4

Isomeric SMILES

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3C(=CC(=N3)C)C)CC4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3/c1-4-20-23(28)25(14-17-8-6-5-7-9-17)19-13-18(10-11-21(19)29-20)22(27)26-16(3)12-15(2)24-26/h5-13,20H,4,14H2,1-3H3