11-diethoxyphosphoryl-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile

Systemtic Name: 11-diethoxyphosphoryl-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile Openeye Name: 11-diethoxyphosphoryl-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile CAS Name: 11-diethoxyphosphoryl-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile IUPAC Name: 11-diethoxyphosphoryl-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile Traditional Name: 11-diethoxyphosphoryl-7,8,9,10-tetrahydrobenzimidazol[1,2-b]isoquinoline-6-carbonitrile Formula: C20H22N3O3P MolecularWeight: 383.380741

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C2CCCCC2=C(C3=NC4=CC=CC=C4N13)C#N)OCC

Isomeric SMILES

CCOP(=O)(C1=C2CCCCC2=C(C3=NC4=CC=CC=C4N13)C#N)OCC

InChI

InChI=1S/C20H22N3O3P/c1-3-25-27(24,26-4-2)20-15-10-6-5-9-14(15)16(13-21)19-22-17-11-7-8-12-18(17)23(19)20/h7-8,11-12H,3-6,9-10H2,1-2H3