4-[(5S)-3,6-bis(oxidanylidene)-5-(phenylmethyl)piperazin-2-yl]butanoic acid

Systemtic Name: 4-[(5S)-3,6-bis(oxidanylidene)-5-(phenylmethyl)piperazin-2-yl]butanoic acid Openeye Name: 4-[(5S)-5-benzyl-3,6-dioxo-piperazin-2-yl]butanoic acid CAS Name: 4-[(5S)-3,6-dioxo-5-(phenylmethyl)-2-piperazinyl]butanoic acid IUPAC Name: 4-[(5S)-5-benzyl-3,6-dioxopiperazin-2-yl]butanoic acid Traditional Name: 4-[(5S)-5-benzyl-3,6-diketo-piperazin-2-yl]butyric acid Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=O)NC(C(=O)N2)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]2C(=O)NC(C(=O)N2)CCCC(=O)O

InChI

InChI=1S/C15H18N2O4/c18-13(19)8-4-7-11-14(20)17-12(15(21)16-11)9-10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2,(H,16,21)(H,17,20)(H,18,19)/t11?,12-/m0/s1