cyclopentane; iron(2+); methyl (3aS,4R,11bR)-3-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]-4-[(2S)-2-methoxycarbonylbutyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate

Systemtic Name: cyclopentane; iron(2+); methyl (3aS,4R,11bR)-3-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]-4-[(2S)-2-methoxycarbonylbutyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate Openeye Name: ferrous; cyclopentane; methyl (3aS,4R,11bR)-3-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]-4-[(2S)-2-methoxycarbonylbutyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate CAS Name: (3aS,4R,11bR)-3-[(1S)-1-(2-diphenylphosphinocyclopentyl)ethyl]-4-[(2S)-2-methoxycarbonylbutyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester; cyclopentane; iron(2+) IUPAC Name: cyclopentane; iron(2+); methyl (3aS,4R,11bR)-3-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]-4-[(2S)-2-methoxycarbonylbutyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate Traditional Name: ferrous; (3aS,4R,11bR)-4-[(2S)-2-carbomethoxybutyl]-3-[(1S)-1-(2-diphenylphosphinocyclopentyl)ethyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester; cyclopentane Formula: C46H49FeN2O4P+2 MolecularWeight: 780.711021

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1CC(=C2C3(C1N(CC3)C(C)[C]4[CH][CH][CH][C]4P(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7N2)C(=O)OC)C(=O)OC.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC[C@@H](C[C@@H]1CC(=C2[C@@]3([C@H]1N(CC3)[C@@H](C)[C]4[CH][CH][CH][C]4P(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7N2)C(=O)OC)C(=O)OC.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C41H44N2O4P.C5H5.Fe/c1-5-28(39(44)46-3)25-29-26-33(40(45)47-4)37-41(34-20-12-13-21-35(34)42-37)23-24-43(38(29)41)27(2)32-19-14-22-36(32)48(30-15-8-6-9-16-30)31-17-10-7-11-18-31;1-2-4-5-3-1;/h6-22,27-29,38,42H,5,23-26H2,1-4H3;1-5H;/q;;+2/t27-,28-,29+,38-,41-;;/m0../s1