methyl (1R,2R)-2-[4-[4-(cyclohexylcarbamoylamino)phenyl]phenyl]carbonylcyclopentane-1-carboxylate

Systemtic Name: methyl (1R,2R)-2-[4-[4-(cyclohexylcarbamoylamino)phenyl]phenyl]carbonylcyclopentane-1-carboxylate Openeye Name: methyl (1R,2R)-2-[4-[4-(cyclohexylcarbamoylamino)phenyl]benzoyl]cyclopentanecarboxylate CAS Name: (1R,2R)-2-[[4-[4-[[(cyclohexylamino)-oxomethyl]amino]phenyl]phenyl]-oxomethyl]-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-2-[4-[4-(cyclohexylcarbamoylamino)phenyl]benzoyl]cyclopentane-1-carboxylate Traditional Name: (1R,2R)-2-[4-[4-(cyclohexylcarbamoylamino)phenyl]benzoyl]cyclopentanecarboxylic acid methyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC1C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)NC(=O)NC4CCCCC4

Isomeric SMILES

COC(=O)[C@@H]1CCC[C@H]1C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)NC(=O)NC4CCCCC4

InChI

InChI=1S/C27H32N2O4/c1-33-26(31)24-9-5-8-23(24)25(30)20-12-10-18(11-13-20)19-14-16-22(17-15-19)29-27(32)28-21-6-3-2-4-7-21/h10-17,21,23-24H,2-9H2,1H3,(H2,28,29,32)/t23-,24-/m1/s1