calcium; [(1S,2S)-1,2-di(cyclopentyl)-2-phenyl-ethyl]benzene; oxolane

Systemtic Name: calcium; [(1S,2S)-1,2-di(cyclopentyl)-2-phenyl-ethyl]benzene; oxolane Openeye Name: calcium; [(1S,2S)-1,2-di(cyclopentyl)-2-phenyl-ethyl]benzene; tetrahydrofuran CAS Name: calcium; [(1S,2S)-1,2-di(cyclopentyl)-2-phenylethyl]benzene; oxolane IUPAC Name: calcium; [(1S,2S)-1,2-di(cyclopentyl)-2-phenylethyl]benzene; oxolane Traditional Name: calcium; [(1S,2S)-1,2-di(cyclopentyl)-2-phenyl-ethyl]benzene; tetrahydrofuran Formula: C32H36CaO2+2 MolecularWeight: 492.70504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC1.C1CCOC1.C1=CC=C(C=C1)C([C]2[CH][CH][CH][CH]2)C(C3=CC=CC=C3)[C]4[CH][CH][CH][CH]4.[Ca+2]

Isomeric SMILES

C1CCOC1.C1CCOC1.C1=CC=C(C=C1)[C@@H]([C]2[CH][CH][CH][CH]2)[C@@H](C3=CC=CC=C3)[C]4[CH][CH][CH][CH]4.[Ca+2]

InChI

InChI=1S/C24H20.2C4H8O.Ca/c1-3-11-19(12-4-1)23(21-15-7-8-16-21)24(22-17-9-10-18-22)20-13-5-2-6-14-20;2*1-2-4-5-3-1;/h1-18,23-24H;2*1-4H2;/q;;;+2/t23-,24-;;;/m0.../s1