3-[3-oxidanylidene-4-[5-(4-oxidanylpiperidin-1-yl)pentyl]quinoxalin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[3-oxidanylidene-4-[5-(4-oxidanylpiperidin-1-yl)pentyl]quinoxalin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-[5-(4-hydroxy-1-piperidyl)pentyl]-3-oxo-quinoxalin-2-yl]benzamidine CAS Name: 3-[4-[5-(4-hydroxy-1-piperidinyl)pentyl]-3-oxo-2-quinoxalinyl]benzenecarboximidamide IUPAC Name: 3-[4-[5-(4-hydroxypiperidin-1-yl)pentyl]-3-oxoquinoxalin-2-yl]benzenecarboximidamide Traditional Name: 3-[4-[5-(4-hydroxypiperidino)pentyl]-3-keto-quinoxalin-2-yl]benzamidine Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CCCCCN2C3=CC=CC=C3N=C(C2=O)C4=CC(=CC=C4)C(=N)N

Isomeric SMILES

C1CN(CCC1O)CCCCCN2C3=CC=CC=C3N=C(C2=O)C4=CC(=CC=C4)C(=N)N

InChI

InChI=1S/C25H31N5O2/c26-24(27)19-8-6-7-18(17-19)23-25(32)30(22-10-3-2-9-21(22)28-23)14-5-1-4-13-29-15-11-20(31)12-16-29/h2-3,6-10,17,20,31H,1,4-5,11-16H2,(H3,26,27)