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

Systemtic Name: methyl 2-azanyl-3-[4-[[3-(1-azanyl-1-azanylidene-3-piperidin-4-yl-propan-2-yl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoate Openeye Name: methyl 2-amino-3-[4-[[3-[2-amino-2-imino-1-(4-piperidylmethyl)ethyl]-2-oxo-oxazolidin-5-yl]methoxy]phenyl]propanoate CAS Name: 2-amino-3-[4-[[3-[1-amino-1-imino-3-(4-piperidinyl)propan-2-yl]-2-oxo-5-oxazolidinyl]methoxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[4-[[3-(1-amino-1-imino-3-piperidin-4-ylpropan-2-yl)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoate Traditional Name: 2-amino-3-[4-[[3-[2-amino-2-imino-1-(4-piperidylmethyl)ethyl]-2-keto-oxazolidin-5-yl]methoxy]phenyl]propionic acid methyl ester Formula: C22H33N5O5 MolecularWeight: 447.52792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)OCC2CN(C(=O)O2)C(CC3CCNCC3)C(=N)N)N

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)OCC2CN(C(=O)O2)C(CC3CCNCC3)C(=N)N)N

InChI

InChI=1S/C22H33N5O5/c1-30-21(28)18(23)10-14-2-4-16(5-3-14)31-13-17-12-27(22(29)32-17)19(20(24)25)11-15-6-8-26-9-7-15/h2-5,15,17-19,26H,6-13,23H2,1H3,(H3,24,25)