3-[3-oxidanylidene-2-(1-oxidanylidene-6-piperidin-4-yloxy-3,4-dihydroisoquinolin-2-yl)butyl]benzenecarboximidamide

Systemtic Name: 3-[3-oxidanylidene-2-(1-oxidanylidene-6-piperidin-4-yloxy-3,4-dihydroisoquinolin-2-yl)butyl]benzenecarboximidamide Openeye Name: 3-[3-oxo-2-[1-oxo-6-(4-piperidyloxy)-3,4-dihydroisoquinolin-2-yl]butyl]benzamidine CAS Name: 3-[3-oxo-2-[1-oxo-6-(4-piperidinyloxy)-3,4-dihydroisoquinolin-2-yl]butyl]benzenecarboximidamide IUPAC Name: 3-[3-oxo-2-(1-oxo-6-piperidin-4-yloxy-3,4-dihydroisoquinolin-2-yl)butyl]benzenecarboximidamide Traditional Name: 3-[3-keto-2-[1-keto-6-(4-piperidyloxy)-3,4-dihydroisoquinolin-2-yl]butyl]benzamidine Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC(=C1)C(=N)N)N2CCC3=C(C2=O)C=CC(=C3)OC4CCNCC4

Isomeric SMILES

CC(=O)C(CC1=CC=CC(=C1)C(=N)N)N2CCC3=C(C2=O)C=CC(=C3)OC4CCNCC4

InChI

InChI=1S/C25H30N4O3/c1-16(30)23(14-17-3-2-4-19(13-17)24(26)27)29-12-9-18-15-21(5-6-22(18)25(29)31)32-20-7-10-28-11-8-20/h2-6,13,15,20,23,28H,7-12,14H2,1H3,(H3,26,27)