tert-butyl 2-carbamimidoyl-4-[5-[(2-ethylpiperazin-1-yl)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]benzoate

Systemtic Name: tert-butyl 2-carbamimidoyl-4-[5-[(2-ethylpiperazin-1-yl)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]benzoate Openeye Name: tert-butyl 2-carbamimidoyl-4-[5-[(2-ethylpiperazin-1-yl)methyl]-2-oxo-oxazolidin-3-yl]benzoate CAS Name: 2-carbamimidoyl-4-[5-[(2-ethyl-1-piperazinyl)methyl]-2-oxo-3-oxazolidinyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-carbamimidoyl-4-[5-[(2-ethylpiperazin-1-yl)methyl]-2-oxo-1,3-oxazolidin-3-yl]benzoate Traditional Name: 2-amidino-4-[5-[(2-ethylpiperazino)methyl]-2-keto-oxazolidin-3-yl]benzoic acid tert-butyl ester Formula: C22H33N5O4 MolecularWeight: 431.52852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CNCCN1CC2CN(C(=O)O2)C3=CC(=C(C=C3)C(=O)OC(C)(C)C)C(=N)N

Isomeric SMILES

CCC1CNCCN1CC2CN(C(=O)O2)C3=CC(=C(C=C3)C(=O)OC(C)(C)C)C(=N)N

InChI

InChI=1S/C22H33N5O4/c1-5-14-11-25-8-9-26(14)12-16-13-27(21(29)30-16)15-6-7-17(18(10-15)19(23)24)20(28)31-22(2,3)4/h6-7,10,14,16,25H,5,8-9,11-13H2,1-4H3,(H3,23,24)