sodium 2-[5-chloranyl-2-methyl-3-[4-(propan-2-ylcarbamoyl)phenoxy]indol-1-yl]ethanoate

Systemtic Name: sodium 2-[5-chloranyl-2-methyl-3-[4-(propan-2-ylcarbamoyl)phenoxy]indol-1-yl]ethanoate Openeye Name: sodium 2-[5-chloro-3-[4-(isopropylcarbamoyl)phenoxy]-2-methyl-indol-1-yl]acetate CAS Name: sodium 2-[5-chloro-2-methyl-3-[4-[oxo-(propan-2-ylamino)methyl]phenoxy]-1-indolyl]acetate IUPAC Name: sodium 2-[5-chloro-2-methyl-3-[4-(propan-2-ylcarbamoyl)phenoxy]indol-1-yl]acetate Traditional Name: sodium 2-[5-chloro-3-[4-(isopropylcarbamoyl)phenoxy]-2-methyl-indol-1-yl]acetate Formula: C21H20ClN2NaO4 MolecularWeight: 422.83727

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)[O-])C=CC(=C2)Cl)OC3=CC=C(C=C3)C(=O)NC(C)C.[Na+]

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)[O-])C=CC(=C2)Cl)OC3=CC=C(C=C3)C(=O)NC(C)C.[Na+]

InChI

InChI=1S/C21H21ClN2O4.Na/c1-12(2)23-21(27)14-4-7-16(8-5-14)28-20-13(3)24(11-19(25)26)18-9-6-15(22)10-17(18)20;/h4-10,12H,11H2,1-3H3,(H,23,27)(H,25,26);/q;+1/p-1