[2-[(4-carboxy-2-methoxy-phenyl)methoxy]-5-chloranyl-4-methyl-phenyl]-propan-2-yl-sulfonyl-azanium; 2-methylfuran

Systemtic Name: [2-[(4-carboxy-2-methoxy-phenyl)methoxy]-5-chloranyl-4-methyl-phenyl]-propan-2-yl-sulfonyl-azanium; 2-methylfuran Openeye Name: [2-[(4-carboxy-2-methoxy-phenyl)methoxy]-5-chloro-4-methyl-phenyl]-isopropyl-sulfonyl-ammonium; 2-methylfuran CAS Name: [2-[(4-carboxy-2-methoxyphenyl)methoxy]-5-chloro-4-methylphenyl]-propan-2-yl-sulfonylammonium; 2-methylfuran IUPAC Name: [2-[(4-carboxy-2-methoxyphenyl)methoxy]-5-chloro-4-methylphenyl]-propan-2-yl-sulfonylazanium; 2-methylfuran Traditional Name: [2-(4-carboxy-2-methoxy-benzyl)oxy-5-chloro-4-methyl-phenyl]-isopropyl-sulfonyl-ammonium; 2-methylfuran Formula: C24H27ClNO7S+ MolecularWeight: 508.99168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CO1.CC1=CC(=C(C=C1Cl)[N+](=S(=O)=O)C(C)C)OCC2=C(C=C(C=C2)C(=O)O)OC

Isomeric SMILES

CC1=CC=CO1.CC1=CC(=C(C=C1Cl)[N+](=S(=O)=O)C(C)C)OCC2=C(C=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C19H20ClNO6S.C5H6O/c1-11(2)21(28(24)25)16-9-15(20)12(3)7-18(16)27-10-14-6-5-13(19(22)23)8-17(14)26-4;1-5-3-2-4-6-5/h5-9,11H,10H2,1-4H3;2-4H,1H3/p+1