3-[3-oxidanylidene-4-[5-(4-oxidanylidenepiperidin-1-yl)pentyl]-1,4-benzoxazin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[3-oxidanylidene-4-[5-(4-oxidanylidenepiperidin-1-yl)pentyl]-1,4-benzoxazin-2-yl]benzenecarboximidamide Openeye Name: 3-[3-oxo-4-[5-(4-oxo-1-piperidyl)pentyl]-1,4-benzoxazin-2-yl]benzamidine CAS Name: 3-[3-oxo-4-[5-(4-oxo-1-piperidinyl)pentyl]-1,4-benzoxazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[3-oxo-4-[5-(4-oxopiperidin-1-yl)pentyl]-1,4-benzoxazin-2-yl]benzenecarboximidamide Traditional Name: 3-[3-keto-4-[5-(4-ketopiperidino)pentyl]-1,4-benzoxazin-2-yl]benzamidine Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CN(CCC1=O)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C25H30N4O3/c26-24(27)19-8-6-7-18(17-19)23-25(31)29(21-9-2-3-10-22(21)32-23)14-5-1-4-13-28-15-11-20(30)12-16-28/h2-3,6-10,17,23H,1,4-5,11-16H2,(H3,26,27)