6-(2-methylbutan-2-yl)-4-[4-oxidanylidene-4-[4-(3-phenylprop-2-enyl)piperazin-1-yl]butyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-(2-methylbutan-2-yl)-4-[4-oxidanylidene-4-[4-(3-phenylprop-2-enyl)piperazin-1-yl]butyl]-1,4-benzoxazin-3-one Openeye Name: 4-[4-(4-cinnamylpiperazin-1-yl)-4-oxo-butyl]-6-(1,1-dimethylpropyl)-1,4-benzoxazin-3-one CAS Name: 6-(2-methylbutan-2-yl)-4-[4-oxo-4-[4-(3-phenylprop-2-enyl)-1-piperazinyl]butyl]-1,4-benzoxazin-3-one IUPAC Name: 6-(2-methylbutan-2-yl)-4-[4-oxo-4-[4-(3-phenylprop-2-enyl)piperazin-1-yl]butyl]-1,4-benzoxazin-3-one Traditional Name: 6-tert-amyl-4-[4-(4-cinnamylpiperazino)-4-keto-butyl]-1,4-benzoxazin-3-one Formula: C30H39N3O3 MolecularWeight: 489.64896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4

InChI

InChI=1S/C30H39N3O3/c1-4-30(2,3)25-14-15-27-26(22-25)33(29(35)23-36-27)17-9-13-28(34)32-20-18-31(19-21-32)16-8-12-24-10-6-5-7-11-24/h5-8,10-12,14-15,22H,4,9,13,16-21,23H2,1-3H3