(3S)-4-(2-azidophenyl)carbonyl-1-ethanoyl-3-propan-2-yl-piperazine-2,5-dione

Systemtic Name: (3S)-4-(2-azidophenyl)carbonyl-1-ethanoyl-3-propan-2-yl-piperazine-2,5-dione Openeye Name: (3S)-1-acetyl-4-(2-azidobenzoyl)-3-isopropyl-piperazine-2,5-dione CAS Name: (3S)-1-acetyl-4-[(2-azidophenyl)-oxomethyl]-3-propan-2-ylpiperazine-2,5-dione IUPAC Name: (3S)-1-acetyl-4-(2-azidobenzoyl)-3-propan-2-ylpiperazine-2,5-dione Traditional Name: (3S)-1-acetyl-4-(2-azidobenzoyl)-3-isopropyl-piperazine-2,5-quinone Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(CC(=O)N1C(=O)C2=CC=CC=C2N=[N+]=[N-])C(=O)C

Isomeric SMILES

CC(C)[C@H]1C(=O)N(CC(=O)N1C(=O)C2=CC=CC=C2N=[N+]=[N-])C(=O)C

InChI

InChI=1S/C16H17N5O4/c1-9(2)14-16(25)20(10(3)22)8-13(23)21(14)15(24)11-6-4-5-7-12(11)18-19-17/h4-7,9,14H,8H2,1-3H3/t14-/m0/s1