N-diphenoxyphosphoryl-4-(4-nitrophenyl)piperazin-1-amine

Systemtic Name: N-diphenoxyphosphoryl-4-(4-nitrophenyl)piperazin-1-amine Openeye Name: N-diphenoxyphosphoryl-4-(4-nitrophenyl)piperazin-1-amine CAS Name: N-diphenoxyphosphoryl-4-(4-nitrophenyl)-1-piperazinamine IUPAC Name: N-diphenoxyphosphoryl-4-(4-nitrophenyl)piperazin-1-amine Traditional Name: diphenoxyphosphoryl-[4-(4-nitrophenyl)piperazino]amine Formula: C22H23N4O5P MolecularWeight: 454.415581

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])NP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])NP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H23N4O5P/c27-26(28)20-13-11-19(12-14-20)24-15-17-25(18-16-24)23-32(29,30-21-7-3-1-4-8-21)31-22-9-5-2-6-10-22/h1-14H,15-18H2,(H,23,29)