9H-fluoren-9-ylmethyl N,N-bis[3-(tert-butylcarbamoylamino)-2-oxidanyl-4-phenyl-butyl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N,N-bis[3-(tert-butylcarbamoylamino)-2-oxidanyl-4-phenyl-butyl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N,N-bis[3-(tert-butylcarbamoylamino)-2-hydroxy-4-phenyl-butyl]carbamate CAS Name: N,N-bis[3-[[(tert-butylamino)-oxomethyl]amino]-2-hydroxy-4-phenylbutyl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N,N-bis[3-(tert-butylcarbamoylamino)-2-hydroxy-4-phenylbutyl]carbamate Traditional Name: N,N-bis[3-(tert-butylcarbamoylamino)-2-hydroxy-4-phenyl-butyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C45H57N5O6 MolecularWeight: 763.96398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(CC1=CC=CC=C1)C(CN(CC(C(CC2=CC=CC=C2)NC(=O)NC(C)(C)C)O)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)O

Isomeric SMILES

CC(C)(C)NC(=O)NC(CC1=CC=CC=C1)C(CN(CC(C(CC2=CC=CC=C2)NC(=O)NC(C)(C)C)O)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)O

InChI

InChI=1S/C45H57N5O6/c1-44(2,3)48-41(53)46-37(25-30-17-9-7-10-18-30)39(51)27-50(28-40(52)38(26-31-19-11-8-12-20-31)47-42(54)49-45(4,5)6)43(55)56-29-36-34-23-15-13-21-32(34)33-22-14-16-24-35(33)36/h7-24,36-40,51-52H,25-29H2,1-6H3,(H2,46,48,53)(H2,47,49,54)