(2S)-5-(4-methylpiperazin-1-yl)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S)-5-(4-methylpiperazin-1-yl)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-5-(4-methylpiperazin-1-yl)-5-oxo-pentanoic acid CAS Name: (2S)-5-(4-methyl-1-piperazinyl)-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S)-5-(4-methylpiperazin-1-yl)-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-keto-5-(4-methylpiperazino)valeric acid Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CN1CCN(CC1)C(=O)CC[C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O5/c1-20-9-11-21(12-10-20)16(22)8-7-15(17(23)24)19-18(25)26-13-14-5-3-2-4-6-14/h2-6,15H,7-13H2,1H3,(H,19,25)(H,23,24)/t15-/m0/s1