3-[3-oxidanylidene-4-(5-piperidin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[3-oxidanylidene-4-(5-piperidin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide Openeye Name: 3-[3-oxo-4-[5-(1-piperidyl)pentyl]-1,4-benzoxazin-2-yl]benzamidine CAS Name: 3-[3-oxo-4-[5-(1-piperidinyl)pentyl]-1,4-benzoxazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[3-oxo-4-(5-piperidin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide Traditional Name: 3-[3-keto-4-(5-piperidinopentyl)-1,4-benzoxazin-2-yl]benzamidine Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CCN(CC1)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C25H32N4O2/c26-24(27)20-11-9-10-19(18-20)23-25(30)29(21-12-3-4-13-22(21)31-23)17-8-2-7-16-28-14-5-1-6-15-28/h3-4,9-13,18,23H,1-2,5-8,14-17H2,(H3,26,27)