2-[5-aminocarbonyl-9-[(3,4-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-oxidanyl-propanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(3,4-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-oxidanyl-propanoic acid Openeye Name: 2-[5-carbamoyl-9-[(3,4-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-hydroxy-propanoic acid CAS Name: 2-[[5-carbamoyl-9-[(3,4-dimethylphenyl)methyl]-4-carbazolyl]oxy]-3-hydroxypropanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(3,4-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-hydroxypropanoic acid Traditional Name: 2-[5-carbamoyl-9-(3,4-dimethylbenzyl)carbazol-4-yl]oxy-3-hydroxy-propionic acid Formula: C25H24N2O5 MolecularWeight: 432.46846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2C3=C(C(=CC=C3)OC(CO)C(=O)O)C4=C(C=CC=C42)C(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN2C3=C(C(=CC=C3)OC(CO)C(=O)O)C4=C(C=CC=C42)C(=O)N)C

InChI

InChI=1S/C25H24N2O5/c1-14-9-10-16(11-15(14)2)12-27-18-6-3-5-17(24(26)29)22(18)23-19(27)7-4-8-20(23)32-21(13-28)25(30)31/h3-11,21,28H,12-13H2,1-2H3,(H2,26,29)(H,30,31)