N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-(3-methylphenyl)-2-oxidanyl-2-piperidin-4-yl-but-3-ynamide

Systemtic Name: N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-(3-methylphenyl)-2-oxidanyl-2-piperidin-4-yl-but-3-ynamide Openeye Name: 2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-(m-tolyl)-2-(4-piperidyl)but-3-ynamide CAS Name: 2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-(3-methylphenyl)-2-(4-piperidinyl)-3-butynamide IUPAC Name: 2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-(3-methylphenyl)-2-piperidin-4-ylbut-3-ynamide Traditional Name: 2-hydroxy-N-(1-keto-4-methyl-2,3-benzoxazin-6-yl)-4-(m-tolyl)-2-(4-piperidyl)but-3-ynamide Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C#CC(C2CCNCC2)(C(=O)NC3=CC4=C(C=C3)C(=O)ON=C4C)O

Isomeric SMILES

CC1=CC=CC(=C1)C#CC(C2CCNCC2)(C(=O)NC3=CC4=C(C=C3)C(=O)ON=C4C)O

InChI

InChI=1S/C25H25N3O4/c1-16-4-3-5-18(14-16)8-11-25(31,19-9-12-26-13-10-19)24(30)27-20-6-7-21-22(15-20)17(2)28-32-23(21)29/h3-7,14-15,19,26,31H,9-10,12-13H2,1-2H3,(H,27,30)