2-[4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]piperazin-1-yl]butanedioic acid

Systemtic Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]piperazin-1-yl]butanedioic acid Openeye Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidin-5-yl]methyl]piperazin-1-yl]butanedioic acid CAS Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]methyl]-1-piperazinyl]butanedioic acid IUPAC Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]piperazin-1-yl]butanedioic acid Traditional Name: 2-[4-[[3-(4-amidinophenyl)-2-keto-oxazolidin-5-yl]methyl]piperazino]succinic acid Formula: C19H25N5O6 MolecularWeight: 419.4317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N)C(CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C19H25N5O6/c20-17(21)12-1-3-13(4-2-12)24-11-14(30-19(24)29)10-22-5-7-23(8-6-22)15(18(27)28)9-16(25)26/h1-4,14-15H,5-11H2,(H3,20,21)(H,25,26)(H,27,28)