4-[2-(5-methyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethyl]-2-propan-2-yl-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-[2-(5-methyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethyl]-2-propan-2-yl-1,4-benzoxazepine-3,5-dione Openeye Name: 2-isopropyl-4-[2-(5-methyl-1-phenyl-pyrazol-4-yl)-2-oxo-ethyl]-1,4-benzoxazepine-3,5-dione CAS Name: 4-[2-(5-methyl-1-phenyl-4-pyrazolyl)-2-oxoethyl]-2-propan-2-yl-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[2-(5-methyl-1-phenylpyrazol-4-yl)-2-oxoethyl]-2-propan-2-yl-1,4-benzoxazepine-3,5-dione Traditional Name: 2-isopropyl-4-[2-keto-2-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]-1,4-benzoxazepine-3,5-quinone Formula: C24H23N3O4 MolecularWeight: 417.45712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)CN3C(=O)C(OC4=CC=CC=C4C3=O)C(C)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)CN3C(=O)C(OC4=CC=CC=C4C3=O)C(C)C

InChI

InChI=1S/C24H23N3O4/c1-15(2)22-24(30)26(23(29)18-11-7-8-12-21(18)31-22)14-20(28)19-13-25-27(16(19)3)17-9-5-4-6-10-17/h4-13,15,22H,14H2,1-3H3