disodium (hexan-2-yloxycarbonylamino) 1-(3-methoxyphenyl)propan-2-yl phosphate

Systemtic Name: disodium (hexan-2-yloxycarbonylamino) 1-(3-methoxyphenyl)propan-2-yl phosphate Openeye Name: disodium [2-(3-methoxyphenyl)-1-methyl-ethyl] (1-methylpentoxycarbonylamino) phosphate CAS Name: disodium [[hexan-2-yloxy(oxo)methyl]amino] 1-(3-methoxyphenyl)propan-2-yl phosphate IUPAC Name: disodium (hexan-2-yloxycarbonylamino) 1-(3-methoxyphenyl)propan-2-yl phosphate Traditional Name: disodium [2-(3-methoxyphenyl)-1-methyl-ethyl] (1-methylpentoxycarbonylamino) phosphate Formula: C34H54N2Na2O14P2 MolecularWeight: 822.724622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)OC(=O)NOP(=O)([O-])OC(C)CC1=CC(=CC=C1)OC.CCCCC(C)OC(=O)NOP(=O)([O-])OC(C)CC1=CC(=CC=C1)OC.[Na+].[Na+]

Isomeric SMILES

CCCCC(C)OC(=O)NOP(=O)([O-])OC(C)CC1=CC(=CC=C1)OC.CCCCC(C)OC(=O)NOP(=O)([O-])OC(C)CC1=CC(=CC=C1)OC.[Na+].[Na+]

InChI

InChI=1S/2C17H28NO7P.2Na/c2*1-5-6-8-13(2)23-17(19)18-25-26(20,21)24-14(3)11-15-9-7-10-16(12-15)22-4;;/h2*7,9-10,12-14H,5-6,8,11H2,1-4H3,(H,18,19)(H,20,21);;/q;;2*+1/p-2