2-diphenoxyphosphoryl-1H-isoquinoline-1-carbonitrile

Systemtic Name: 2-diphenoxyphosphoryl-1H-isoquinoline-1-carbonitrile Openeye Name: 2-diphenoxyphosphoryl-1H-isoquinoline-1-carbonitrile CAS Name: 2-diphenoxyphosphoryl-1H-isoquinoline-1-carbonitrile IUPAC Name: 2-diphenoxyphosphoryl-1H-isoquinoline-1-carbonitrile Traditional Name: 2-diphenoxyphosphoryl-1H-isoquinoline-1-carbonitrile Formula: C22H17N2O3P MolecularWeight: 388.355741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(N2C=CC3=CC=CC=C3C2C#N)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(N2C=CC3=CC=CC=C3C2C#N)OC4=CC=CC=C4

InChI

InChI=1S/C22H17N2O3P/c23-17-22-21-14-8-7-9-18(21)15-16-24(22)28(25,26-19-10-3-1-4-11-19)27-20-12-5-2-6-13-20/h1-16,22H