2-[5-aminocarbonyl-9-(pyridin-3-ylmethyl)carbazol-4-yl]oxy-2-thiophen-2-yl-ethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-(pyridin-3-ylmethyl)carbazol-4-yl]oxy-2-thiophen-2-yl-ethanoic acid Openeye Name: 2-[5-carbamoyl-9-(3-pyridylmethyl)carbazol-4-yl]oxy-2-(2-thienyl)acetic acid CAS Name: 2-[[5-carbamoyl-9-(3-pyridinylmethyl)-4-carbazolyl]oxy]-2-thiophen-2-ylacetic acid IUPAC Name: 2-[5-carbamoyl-9-(pyridin-3-ylmethyl)carbazol-4-yl]oxy-2-thiophen-2-ylacetic acid Traditional Name: 2-[5-carbamoyl-9-(3-pyridylmethyl)carbazol-4-yl]oxy-2-(2-thienyl)acetic acid Formula: C25H19N3O4S MolecularWeight: 457.50106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(C4=CC=CS4)C(=O)O)CC5=CN=CC=C5)C(=O)N

Isomeric SMILES

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(C4=CC=CS4)C(=O)O)CC5=CN=CC=C5)C(=O)N

InChI

InChI=1S/C25H19N3O4S/c26-24(29)16-6-1-7-17-21(16)22-18(28(17)14-15-5-3-11-27-13-15)8-2-9-19(22)32-23(25(30)31)20-10-4-12-33-20/h1-13,23H,14H2,(H2,26,29)(H,30,31)