sodium 2-[(3R)-4-[(4-chlorophenyl)methyl]-5-(1-hydroxyethyl)-7-methylsulfonyl-2,3-dihydro-1H-cyclopenta[b]indol-3-yl]ethanoate

Systemtic Name: sodium 2-[(3R)-4-[(4-chlorophenyl)methyl]-5-(1-hydroxyethyl)-7-methylsulfonyl-2,3-dihydro-1H-cyclopenta[b]indol-3-yl]ethanoate Openeye Name: sodium 2-[(3R)-4-[(4-chlorophenyl)methyl]-5-(1-hydroxyethyl)-7-methylsulfonyl-2,3-dihydro-1H-cyclopenta[b]indol-3-yl]acetate CAS Name: sodium 2-[(3R)-4-[(4-chlorophenyl)methyl]-5-(1-hydroxyethyl)-7-methylsulfonyl-2,3-dihydro-1H-cyclopenta[b]indol-3-yl]acetate IUPAC Name: sodium 2-[(3R)-4-[(4-chlorophenyl)methyl]-5-(1-hydroxyethyl)-7-methylsulfonyl-2,3-dihydro-1H-cyclopenta[b]indol-3-yl]acetate Traditional Name: sodium 2-[(3R)-4-(4-chlorobenzyl)-5-(1-hydroxyethyl)-7-mesyl-2,3-dihydro-1H-cyclopent[b]indol-3-yl]acetate Formula: C23H23ClNNaO5S MolecularWeight: 483.94019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C(=CC(=C1)S(=O)(=O)C)C3=C(N2CC4=CC=C(C=C4)Cl)C(CC3)CC(=O)[O-])O.[Na+]

Isomeric SMILES

CC(C1=C2C(=CC(=C1)S(=O)(=O)C)C3=C(N2CC4=CC=C(C=C4)Cl)[C@H](CC3)CC(=O)[O-])O.[Na+]

InChI

InChI=1S/C23H24ClNO5S.Na/c1-13(26)19-10-17(31(2,29)30)11-20-18-8-5-15(9-21(27)28)22(18)25(23(19)20)12-14-3-6-16(24)7-4-14;/h3-4,6-7,10-11,13,15,26H,5,8-9,12H2,1-2H3,(H,27,28);/q;+1/p-1/t13?,15-;/m1./s1