tert-butyl 2-[2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]ethyl-[(2R)-2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]-3-[octoxy(oxidanyl)phosphoryl]oxy-propyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]ethyl-[(2R)-2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]-3-[octoxy(oxidanyl)phosphoryl]oxy-propyl]amino]ethanoate Openeye Name: tert-butyl 2-[2-[bis(2-tert-butoxy-2-oxo-ethyl)amino]ethyl-[(2R)-2-[bis(2-tert-butoxy-2-oxo-ethyl)amino]-3-[hydroxy(octoxy)phosphoryl]oxy-propyl]amino]acetate CAS Name: 2-[2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]ethyl-[(2R)-2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-3-[hydroxy(octoxy)phosphoryl]oxypropyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]ethyl-[(2R)-2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-3-[hydroxy(octoxy)phosphoryl]oxypropyl]amino]acetate Traditional Name: 2-[2-[bis(2-tert-butoxy-2-keto-ethyl)amino]ethyl-[(2R)-2-[bis(2-tert-butoxy-2-keto-ethyl)amino]-3-[hydroxy(octoxy)phosphoryl]oxy-propyl]amino]acetic acid tert-butyl ester Formula: C43H82N3O14P MolecularWeight: 896.096641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(O)OCC(CN(CCN(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)N(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCOP(=O)(O)OC[C@@H](CN(CCN(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)N(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C

InChI

InChI=1S/C43H82N3O14P/c1-17-18-19-20-21-22-25-54-61(52,53)55-32-33(46(30-37(50)59-42(11,12)13)31-38(51)60-43(14,15)16)26-44(27-34(47)56-39(2,3)4)23-24-45(28-35(48)57-40(5,6)7)29-36(49)58-41(8,9)10/h33H,17-32H2,1-16H3,(H,52,53)/t33-/m1/s1