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

Systemtic Name: 2-[5-aminocarbonyl-9-(thiophen-3-ylmethyl)carbazol-4-yl]oxy-3-methyl-butanoic acid Openeye Name: 2-[5-carbamoyl-9-(3-thienylmethyl)carbazol-4-yl]oxy-3-methyl-butanoic acid CAS Name: 2-[[5-carbamoyl-9-(3-thiophenylmethyl)-4-carbazolyl]oxy]-3-methylbutanoic acid IUPAC Name: 2-[5-carbamoyl-9-(thiophen-3-ylmethyl)carbazol-4-yl]oxy-3-methylbutanoic acid Traditional Name: 2-[5-carbamoyl-9-(3-thenyl)carbazol-4-yl]oxy-3-methyl-butyric acid Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O4S/c1-13(2)21(23(27)28)29-18-8-4-7-17-20(18)19-15(22(24)26)5-3-6-16(19)25(17)11-14-9-10-30-12-14/h3-10,12-13,21H,11H2,1-2H3,(H2,24,26)(H,27,28)