2-[5-aminocarbonyl-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxy-2-(furan-2-yl)ethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxy-2-(furan-2-yl)ethanoic acid Openeye Name: 2-[5-carbamoyl-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxy-2-(2-furyl)acetic acid CAS Name: 2-[[5-carbamoyl-9-[(3-methylsulfonylphenyl)methyl]-4-carbazolyl]oxy]-2-(2-furanyl)acetic acid IUPAC Name: 2-[5-carbamoyl-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxy-2-(furan-2-yl)acetic acid Traditional Name: 2-[5-carbamoyl-9-(3-mesylbenzyl)carbazol-4-yl]oxy-2-(2-furyl)acetic acid Formula: C27H22N2O7S MolecularWeight: 518.53778

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)CN2C3=C(C(=CC=C3)OC(C4=CC=CO4)C(=O)O)C5=C(C=CC=C52)C(=O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)CN2C3=C(C(=CC=C3)OC(C4=CC=CO4)C(=O)O)C5=C(C=CC=C52)C(=O)N

InChI

InChI=1S/C27H22N2O7S/c1-37(33,34)17-7-2-6-16(14-17)15-29-19-9-3-8-18(26(28)30)23(19)24-20(29)10-4-11-21(24)36-25(27(31)32)22-12-5-13-35-22/h2-14,25H,15H2,1H3,(H2,28,30)(H,31,32)