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

Systemtic Name: 2-[5-aminocarbonyl-9-[(2-ethylphenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid Openeye Name: 2-[5-carbamoyl-9-[(2-ethylphenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid CAS Name: 2-[[5-carbamoyl-9-[(2-ethylphenyl)methyl]-4-carbazolyl]oxy]-3-methylbutanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(2-ethylphenyl)methyl]carbazol-4-yl]oxy-3-methylbutanoic acid Traditional Name: 2-[5-carbamoyl-9-(2-ethylbenzyl)carbazol-4-yl]oxy-3-methyl-butyric acid Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CN2C3=C(C(=CC=C3)OC(C(C)C)C(=O)O)C4=C(C=CC=C42)C(=O)N

Isomeric SMILES

CCC1=CC=CC=C1CN2C3=C(C(=CC=C3)OC(C(C)C)C(=O)O)C4=C(C=CC=C42)C(=O)N

InChI

InChI=1S/C27H28N2O4/c1-4-17-9-5-6-10-18(17)15-29-20-12-7-11-19(26(28)30)23(20)24-21(29)13-8-14-22(24)33-25(16(2)3)27(31)32/h5-14,16,25H,4,15H2,1-3H3,(H2,28,30)(H,31,32)