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

Systemtic Name: 2-[5-aminocarbonyl-9-(thiophen-3-ylmethyl)carbazol-4-yl]oxy-3-oxidanyl-propanoic acid Openeye Name: 2-[5-carbamoyl-9-(3-thienylmethyl)carbazol-4-yl]oxy-3-hydroxy-propanoic acid CAS Name: 2-[[5-carbamoyl-9-(3-thiophenylmethyl)-4-carbazolyl]oxy]-3-hydroxypropanoic acid IUPAC Name: 2-[5-carbamoyl-9-(thiophen-3-ylmethyl)carbazol-4-yl]oxy-3-hydroxypropanoic acid Traditional Name: 2-[5-carbamoyl-9-(3-thenyl)carbazol-4-yl]oxy-3-hydroxy-propionic acid Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(CO)C(=O)O)CC4=CSC=C4)C(=O)N

Isomeric SMILES

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(CO)C(=O)O)CC4=CSC=C4)C(=O)N

InChI

InChI=1S/C21H18N2O5S/c22-20(25)13-3-1-4-14-18(13)19-15(23(14)9-12-7-8-29-11-12)5-2-6-16(19)28-17(10-24)21(26)27/h1-8,11,17,24H,9-10H2,(H2,22,25)(H,26,27)