methyl 2-azanyl-3-[4-[[3-(1-azanyl-1-azanylidene-2-piperazin-1-yl-butan-2-yl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoate

Systemtic Name: methyl 2-azanyl-3-[4-[[3-(1-azanyl-1-azanylidene-2-piperazin-1-yl-butan-2-yl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoate Openeye Name: methyl 2-amino-3-[4-[[3-(1-carbamimidoyl-1-piperazin-1-yl-propyl)-2-oxo-oxazolidin-5-yl]methoxy]phenyl]propanoate CAS Name: 2-amino-3-[4-[[3-[1-amino-1-imino-2-(1-piperazinyl)butan-2-yl]-2-oxo-5-oxazolidinyl]methoxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[4-[[3-(1-amino-1-imino-2-piperazin-1-ylbutan-2-yl)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoate Traditional Name: 3-[4-[[3-(1-amidino-1-piperazino-propyl)-2-keto-oxazolidin-5-yl]methoxy]phenyl]-2-amino-propionic acid methyl ester Formula: C22H34N6O5 MolecularWeight: 462.54256

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=N)N)(N1CCNCC1)N2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)OC)N

Isomeric SMILES

CCC(C(=N)N)(N1CCNCC1)N2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)OC)N

InChI

InChI=1S/C22H34N6O5/c1-3-22(20(24)25,27-10-8-26-9-11-27)28-13-17(33-21(28)30)14-32-16-6-4-15(5-7-16)12-18(23)19(29)31-2/h4-7,17-18,26H,3,8-14,23H2,1-2H3,(H3,24,25)