[(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] (3aS,6aR)-2-oxidanylidene-3,3a,4,6a-tetrahydro-1H-pentalene-1-carboxylate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] (3aS,6aR)-2-oxidanylidene-3,3a,4,6a-tetrahydro-1H-pentalene-1-carboxylate Openeye Name: [(1R)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] (3aS,6aR)-2-oxo-3,3a,4,6a-tetrahydro-1H-pentalene-1-carboxylate CAS Name: (3aS,6aR)-2-oxo-3,3a,4,6a-tetrahydro-1H-pentalene-1-carboxylic acid [(1R)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: [(1R)-2-oxo-1-phenyl-2-piperidin-1-ylethyl] (3aS,6aR)-2-oxo-3,3a,4,6a-tetrahydro-1H-pentalene-1-carboxylate Traditional Name: (3aS,6aR)-2-keto-3,3a,4,6a-tetrahydro-1H-pentalene-1-carboxylic acid [(1R)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3C4C=CCC4CC3=O

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3[C@H]4C=CC[C@H]4CC3=O

InChI

InChI=1S/C22H25NO4/c24-18-14-16-10-7-11-17(16)19(18)22(26)27-20(15-8-3-1-4-9-15)21(25)23-12-5-2-6-13-23/h1,3-4,7-9,11,16-17,19-20H,2,5-6,10,12-14H2/t16-,17-,19?,20+/m0/s1