tert-butyl N-[4-bis(phenylmethoxy)phosphoryl-1-[(3-hexylphenyl)amino]-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-bis(phenylmethoxy)phosphoryl-1-[(3-hexylphenyl)amino]-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[3-dibenzyloxyphosphoryl-1-[(3-hexylphenyl)carbamoyl]propyl]carbamate CAS Name: N-[4-bis(phenylmethoxy)phosphoryl-1-(3-hexylanilino)-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-bis(phenylmethoxy)phosphoryl-1-(3-hexylanilino)-1-oxobutan-2-yl]carbamate Traditional Name: N-[3-dibenzoxyphosphoryl-1-[(3-hexylphenyl)carbamoyl]propyl]carbamic acid tert-butyl ester Formula: C35H47N2O6P MolecularWeight: 622.731241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=CC=C1)NC(=O)C(CCP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC1=CC(=CC=C1)NC(=O)C(CCP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C35H47N2O6P/c1-5-6-7-10-16-28-21-15-22-31(25-28)36-33(38)32(37-34(39)43-35(2,3)4)23-24-44(40,41-26-29-17-11-8-12-18-29)42-27-30-19-13-9-14-20-30/h8-9,11-15,17-22,25,32H,5-7,10,16,23-24,26-27H2,1-4H3,(H,36,38)(H,37,39)