(2S)-2-benzamido-5-oxidanylidene-5-(4-prop-2-enylpiperazin-1-yl)pentanoic acid

Systemtic Name: (2S)-2-benzamido-5-oxidanylidene-5-(4-prop-2-enylpiperazin-1-yl)pentanoic acid Openeye Name: (2S)-5-(4-allylpiperazin-1-yl)-2-benzamido-5-oxo-pentanoic acid CAS Name: (2S)-2-benzamido-5-oxo-5-(4-prop-2-enyl-1-piperazinyl)pentanoic acid IUPAC Name: (2S)-2-benzamido-5-oxo-5-(4-prop-2-enylpiperazin-1-yl)pentanoic acid Traditional Name: (2S)-5-(4-allylpiperazino)-2-benzamido-5-keto-valeric acid Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C(=O)CCC(C(=O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C=CCN1CCN(CC1)C(=O)CC[C@@H](C(=O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H25N3O4/c1-2-10-21-11-13-22(14-12-21)17(23)9-8-16(19(25)26)20-18(24)15-6-4-3-5-7-15/h2-7,16H,1,8-14H2,(H,20,24)(H,25,26)/t16-/m0/s1