4-[6-(2-methylbutan-2-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[1-(phenylmethyl)piperidin-4-yl]butanamide

Systemtic Name: 4-[6-(2-methylbutan-2-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[1-(phenylmethyl)piperidin-4-yl]butanamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-[6-(1,1-dimethylpropyl)-3-oxo-1,4-benzoxazin-4-yl]butanamide CAS Name: 4-[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]-N-[1-(phenylmethyl)-4-piperidinyl]butanamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]butanamide Traditional Name: 4-(6-tert-amyl-3-keto-1,4-benzoxazin-4-yl)-N-(1-benzyl-4-piperidyl)butyramide Formula: C29H39N3O3 MolecularWeight: 477.63826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C29H39N3O3/c1-4-29(2,3)23-12-13-26-25(19-23)32(28(34)21-35-26)16-8-11-27(33)30-24-14-17-31(18-15-24)20-22-9-6-5-7-10-22/h5-7,9-10,12-13,19,24H,4,8,11,14-18,20-21H2,1-3H3,(H,30,33)