2-[5-aminocarbonyl-2-ethyl-9-[[3-(phenylmethyl)phenyl]methyl]carbazol-4-yl]oxyethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-2-ethyl-9-[[3-(phenylmethyl)phenyl]methyl]carbazol-4-yl]oxyethanoic acid Openeye Name: 2-[9-[(3-benzylphenyl)methyl]-5-carbamoyl-2-ethyl-carbazol-4-yl]oxyacetic acid CAS Name: 2-[[5-carbamoyl-2-ethyl-9-[[3-(phenylmethyl)phenyl]methyl]-4-carbazolyl]oxy]acetic acid IUPAC Name: 2-[9-[(3-benzylphenyl)methyl]-5-carbamoyl-2-ethylcarbazol-4-yl]oxyacetic acid Traditional Name: 2-[9-(3-benzylbenzyl)-5-carbamoyl-2-ethyl-carbazol-4-yl]oxyacetic acid Formula: C31H28N2O4 MolecularWeight: 492.56502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C(=C1)OCC(=O)O)C3=C(C=CC=C3N2CC4=CC=CC(=C4)CC5=CC=CC=C5)C(=O)N

Isomeric SMILES

CCC1=CC2=C(C(=C1)OCC(=O)O)C3=C(C=CC=C3N2CC4=CC=CC(=C4)CC5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C31H28N2O4/c1-2-20-16-26-30(27(17-20)37-19-28(34)35)29-24(31(32)36)12-7-13-25(29)33(26)18-23-11-6-10-22(15-23)14-21-8-4-3-5-9-21/h3-13,15-17H,2,14,18-19H2,1H3,(H2,32,36)(H,34,35)