[(E,1S,7R)-1-cyclohexyl-7-(methoxycarbonylamino)oct-2-enyl] benzoate

Systemtic Name: [(E,1S,7R)-1-cyclohexyl-7-(methoxycarbonylamino)oct-2-enyl] benzoate Openeye Name: [(E,1S,7R)-1-cyclohexyl-7-(methoxycarbonylamino)oct-2-enyl] benzoate CAS Name: benzoic acid [(E,1S,7R)-1-cyclohexyl-7-(methoxycarbonylamino)oct-2-enyl] ester IUPAC Name: [(E,1S,7R)-1-cyclohexyl-7-(methoxycarbonylamino)oct-2-enyl] benzoate Traditional Name: benzoic acid [(E,1S,7R)-7-(carbomethoxyamino)-1-cyclohexyl-oct-2-enyl] ester Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC=CC(C1CCCCC1)OC(=O)C2=CC=CC=C2)NC(=O)OC

Isomeric SMILES

C[C@H](CCC/C=C/[C@H](C1CCCCC1)OC(=O)C2=CC=CC=C2)NC(=O)OC

InChI

InChI=1S/C23H33NO4/c1-18(24-23(26)27-2)12-6-3-11-17-21(19-13-7-4-8-14-19)28-22(25)20-15-9-5-10-16-20/h5,9-11,15-19,21H,3-4,6-8,12-14H2,1-2H3,(H,24,26)/b17-11+/t18-,21-/m1/s1