[2,6-ditert-butyl-4-[[2-(heptylcarbamoylamino)phenyl]carbamoyl]phenyl] N-heptylcarbamate

Systemtic Name: [2,6-ditert-butyl-4-[[2-(heptylcarbamoylamino)phenyl]carbamoyl]phenyl] N-heptylcarbamate Openeye Name: [2,6-ditert-butyl-4-[[2-(heptylcarbamoylamino)phenyl]carbamoyl]phenyl] N-heptylcarbamate CAS Name: N-heptylcarbamic acid [2,6-ditert-butyl-4-[[2-[[(heptylamino)-oxomethyl]amino]anilino]-oxomethyl]phenyl] ester IUPAC Name: [2,6-ditert-butyl-4-[[2-(heptylcarbamoylamino)phenyl]carbamoyl]phenyl] N-heptylcarbamate Traditional Name: N-heptylcarbamic acid [2,6-ditert-butyl-4-[[2-(heptylcarbamoylamino)phenyl]carbamoyl]phenyl] ester Formula: C37H58N4O4 MolecularWeight: 622.88082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)NC1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)C(C)(C)C)OC(=O)NCCCCCCC)C(C)(C)C

Isomeric SMILES

CCCCCCCNC(=O)NC1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)C(C)(C)C)OC(=O)NCCCCCCC)C(C)(C)C

InChI

InChI=1S/C37H58N4O4/c1-9-11-13-15-19-23-38-34(43)41-31-22-18-17-21-30(31)40-33(42)27-25-28(36(3,4)5)32(29(26-27)37(6,7)8)45-35(44)39-24-20-16-14-12-10-2/h17-18,21-22,25-26H,9-16,19-20,23-24H2,1-8H3,(H,39,44)(H,40,42)(H2,38,41,43)