2-[[2-(4-bromophenyl)-2-cyclohexyl-ethyl]-(phenylmethyl)amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-(4-bromophenyl)-2-cyclohexyl-ethyl]-(phenylmethyl)amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[benzyl-[2-(4-bromophenyl)-2-cyclohexyl-ethyl]amino]-2-oxo-acetic acid CAS Name: 2-[[2-(4-bromophenyl)-2-cyclohexylethyl]-(phenylmethyl)amino]-2-oxoacetic acid IUPAC Name: 2-[benzyl-[2-(4-bromophenyl)-2-cyclohexylethyl]amino]-2-oxoacetic acid Traditional Name: 2-[benzyl-[2-(4-bromophenyl)-2-cyclohexyl-ethyl]amino]-2-keto-acetic acid Formula: C23H26BrNO3 MolecularWeight: 444.36144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CN(CC2=CC=CC=C2)C(=O)C(=O)O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)C(CN(CC2=CC=CC=C2)C(=O)C(=O)O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H26BrNO3/c24-20-13-11-19(12-14-20)21(18-9-5-2-6-10-18)16-25(22(26)23(27)28)15-17-7-3-1-4-8-17/h1,3-4,7-8,11-14,18,21H,2,5-6,9-10,15-16H2,(H,27,28)