[2-[(3-cyano-4-phenyl-phenyl)methyl]-1-[(pentanoylamino)methyl]cyclohexyl] ethyl carbonate

Systemtic Name: [2-[(3-cyano-4-phenyl-phenyl)methyl]-1-[(pentanoylamino)methyl]cyclohexyl] ethyl carbonate Openeye Name: [2-[(3-cyano-4-phenyl-phenyl)methyl]-1-[(pentanoylamino)methyl]cyclohexyl] ethyl carbonate CAS Name: carbonic acid [2-[(3-cyano-4-phenylphenyl)methyl]-1-[(1-oxopentylamino)methyl]cyclohexyl] ethyl ester IUPAC Name: [2-[(3-cyano-4-phenylphenyl)methyl]-1-[(pentanoylamino)methyl]cyclohexyl] ethyl carbonate Traditional Name: carbonic acid [2-(3-cyano-4-phenyl-benzyl)-1-[(valerylamino)methyl]cyclohexyl] ethyl ester Formula: C29H36N2O4 MolecularWeight: 476.60714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NCC1(CCCCC1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)OC(=O)OCC

Isomeric SMILES

CCCCC(=O)NCC1(CCCCC1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)OC(=O)OCC

InChI

InChI=1S/C29H36N2O4/c1-3-5-14-27(32)31-21-29(35-28(33)34-4-2)17-10-9-13-25(29)19-22-15-16-26(24(18-22)20-30)23-11-7-6-8-12-23/h6-8,11-12,15-16,18,25H,3-5,9-10,13-14,17,19,21H2,1-2H3,(H,31,32)