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

Systemtic Name: 2-[5-aminocarbonyl-9-(thiophen-3-ylmethyl)carbazol-4-yl]oxypropanoic acid Openeye Name: 2-[5-carbamoyl-9-(3-thienylmethyl)carbazol-4-yl]oxypropanoic acid CAS Name: 2-[[5-carbamoyl-9-(3-thiophenylmethyl)-4-carbazolyl]oxy]propanoic acid IUPAC Name: 2-[5-carbamoyl-9-(thiophen-3-ylmethyl)carbazol-4-yl]oxypropanoic acid Traditional Name: 2-[5-carbamoyl-9-(3-thenyl)carbazol-4-yl]oxypropionic acid Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CSC=C4)C(=O)N

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CSC=C4)C(=O)N

InChI

InChI=1S/C21H18N2O4S/c1-12(21(25)26)27-17-7-3-6-16-19(17)18-14(20(22)24)4-2-5-15(18)23(16)10-13-8-9-28-11-13/h2-9,11-12H,10H2,1H3,(H2,22,24)(H,25,26)