(3S,6S)-6-(1H-indol-3-ylmethyl)-1-methyl-3-[(1R)-1-oxidanylethyl]piperazine-2,5-dione

Systemtic Name: (3S,6S)-6-(1H-indol-3-ylmethyl)-1-methyl-3-[(1R)-1-oxidanylethyl]piperazine-2,5-dione Openeye Name: (3S,6S)-3-[(1R)-1-hydroxyethyl]-6-(1H-indol-3-ylmethyl)-1-methyl-piperazine-2,5-dione CAS Name: (3S,6S)-3-[(1R)-1-hydroxyethyl]-6-(1H-indol-3-ylmethyl)-1-methylpiperazine-2,5-dione IUPAC Name: (3S,6S)-3-[(1R)-1-hydroxyethyl]-6-(1H-indol-3-ylmethyl)-1-methylpiperazine-2,5-dione Traditional Name: (3S,6S)-3-[(1R)-1-hydroxyethyl]-6-(1H-indol-3-ylmethyl)-1-methyl-piperazine-2,5-quinone Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)N(C(C(=O)N1)CC2=CNC3=CC=CC=C32)C)O

Isomeric SMILES

C[C@H]([C@H]1C(=O)N([C@H](C(=O)N1)CC2=CNC3=CC=CC=C32)C)O

InChI

InChI=1S/C16H19N3O3/c1-9(20)14-16(22)19(2)13(15(21)18-14)7-10-8-17-12-6-4-3-5-11(10)12/h3-6,8-9,13-14,17,20H,7H2,1-2H3,(H,18,21)/t9-,13+,14+/m1/s1