3-[(8-chloranyl-2,3-dimethyl-4-oxidanylidene-2H-1,3-benzoxazin-7-yl)oxy]-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylbutan-2-yl]oxy-benzamide

Systemtic Name: 3-[(8-chloranyl-2,3-dimethyl-4-oxidanylidene-2H-1,3-benzoxazin-7-yl)oxy]-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylbutan-2-yl]oxy-benzamide Openeye Name: 3-[(8-chloro-2,3-dimethyl-4-oxo-2H-1,3-benzoxazin-7-yl)oxy]-5-[(1S)-1-(hydroxymethyl)propoxy]-N-(1-methylpyrazol-3-yl)benzamide CAS Name: 3-[(8-chloro-2,3-dimethyl-4-oxo-2H-1,3-benzoxazin-7-yl)oxy]-5-[(2S)-1-hydroxybutan-2-yl]oxy-N-(1-methyl-3-pyrazolyl)benzamide IUPAC Name: 3-[(8-chloro-2,3-dimethyl-4-oxo-2H-1,3-benzoxazin-7-yl)oxy]-5-[(2S)-1-hydroxybutan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide Traditional Name: 3-[(8-chloro-4-keto-2,3-dimethyl-2H-1,3-benzoxazin-7-yl)oxy]-5-[(1S)-1-methylolpropoxy]-N-(1-methylpyrazol-3-yl)benzamide Formula: C25H27ClN4O6 MolecularWeight: 514.95808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)OC1=CC(=CC(=C1)OC2=C(C3=C(C=C2)C(=O)N(C(O3)C)C)Cl)C(=O)NC4=NN(C=C4)C

Isomeric SMILES

CC[C@@H](CO)OC1=CC(=CC(=C1)OC2=C(C3=C(C=C2)C(=O)N(C(O3)C)C)Cl)C(=O)NC4=NN(C=C4)C

InChI

InChI=1S/C25H27ClN4O6/c1-5-16(13-31)35-17-10-15(24(32)27-21-8-9-29(3)28-21)11-18(12-17)36-20-7-6-19-23(22(20)26)34-14(2)30(4)25(19)33/h6-12,14,16,31H,5,13H2,1-4H3,(H,27,28,32)/t14?,16-/m0/s1