N-[1-bis(phenylmethoxy)phosphoryl-3-(3,4-dichlorophenyl)-1-oxidanyl-propan-2-yl]quinoline-3-carboxamide

Systemtic Name: N-[1-bis(phenylmethoxy)phosphoryl-3-(3,4-dichlorophenyl)-1-oxidanyl-propan-2-yl]quinoline-3-carboxamide Openeye Name: N-[2-dibenzyloxyphosphoryl-1-[(3,4-dichlorophenyl)methyl]-2-hydroxy-ethyl]quinoline-3-carboxamide CAS Name: N-[1-bis(phenylmethoxy)phosphoryl-3-(3,4-dichlorophenyl)-1-hydroxypropan-2-yl]-3-quinolinecarboxamide IUPAC Name: N-[1-bis(phenylmethoxy)phosphoryl-3-(3,4-dichlorophenyl)-1-hydroxypropan-2-yl]quinoline-3-carboxamide Traditional Name: N-[2-dibenzoxyphosphoryl-1-(3,4-dichlorobenzyl)-2-hydroxy-ethyl]quinoline-3-carboxamide Formula: C33H29Cl2N2O5P MolecularWeight: 635.473521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COP(=O)(C(C(CC2=CC(=C(C=C2)Cl)Cl)NC(=O)C3=CC4=CC=CC=C4N=C3)O)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COP(=O)(C(C(CC2=CC(=C(C=C2)Cl)Cl)NC(=O)C3=CC4=CC=CC=C4N=C3)O)OCC5=CC=CC=C5

InChI

InChI=1S/C33H29Cl2N2O5P/c34-28-16-15-25(17-29(28)35)18-31(37-32(38)27-19-26-13-7-8-14-30(26)36-20-27)33(39)43(40,41-21-23-9-3-1-4-10-23)42-22-24-11-5-2-6-12-24/h1-17,19-20,31,33,39H,18,21-22H2,(H,37,38)