(3S,6S)-3-(1H-indol-3-ylmethyl)-6-(phenylmethoxymethyl)piperazine-2,5-dione

Systemtic Name: (3S,6S)-3-(1H-indol-3-ylmethyl)-6-(phenylmethoxymethyl)piperazine-2,5-dione Openeye Name: (3S,6S)-3-(benzyloxymethyl)-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione CAS Name: (3S,6S)-3-(1H-indol-3-ylmethyl)-6-(phenylmethoxymethyl)piperazine-2,5-dione IUPAC Name: (3S,6S)-3-(1H-indol-3-ylmethyl)-6-(phenylmethoxymethyl)piperazine-2,5-dione Traditional Name: (3S,6S)-3-(benzoxymethyl)-6-(1H-indol-3-ylmethyl)piperazine-2,5-quinone Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C(=O)NC(C(=O)N2)CC3=CNC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)COC[C@H]2C(=O)N[C@H](C(=O)N2)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H21N3O3/c25-20-18(10-15-11-22-17-9-5-4-8-16(15)17)23-21(26)19(24-20)13-27-12-14-6-2-1-3-7-14/h1-9,11,18-19,22H,10,12-13H2,(H,23,26)(H,24,25)/t18-,19-/m0/s1