4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-1-(phenylmethyl)piperazine-2-carboxylic acid

Systemtic Name: 4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-1-(phenylmethyl)piperazine-2-carboxylic acid Openeye Name: 1-benzyl-4-[[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidin-5-yl]methyl]piperazine-2-carboxylic acid CAS Name: 4-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]methyl]-1-(phenylmethyl)-2-piperazinecarboxylic acid IUPAC Name: 1-benzyl-4-[[3-(4-carbamimidoylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]piperazine-2-carboxylic acid Traditional Name: 4-[[3-(4-amidinophenyl)-2-keto-oxazolidin-5-yl]methyl]-1-benzyl-piperazine-2-carboxylic acid Formula: C23H27N5O4 MolecularWeight: 437.49158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(C(CN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O4/c24-21(25)17-6-8-18(9-7-17)28-14-19(32-23(28)31)13-26-10-11-27(20(15-26)22(29)30)12-16-4-2-1-3-5-16/h1-9,19-20H,10-15H2,(H3,24,25)(H,29,30)