(3R,6S)-1-(2-azidophenyl)carbonyl-3-(1H-indol-3-ylmethyl)-6-methyl-piperazine-2,5-dione

Systemtic Name: (3R,6S)-1-(2-azidophenyl)carbonyl-3-(1H-indol-3-ylmethyl)-6-methyl-piperazine-2,5-dione Openeye Name: (3R,6S)-1-(2-azidobenzoyl)-3-(1H-indol-3-ylmethyl)-6-methyl-piperazine-2,5-dione CAS Name: (3R,6S)-1-[(2-azidophenyl)-oxomethyl]-3-(1H-indol-3-ylmethyl)-6-methylpiperazine-2,5-dione IUPAC Name: (3R,6S)-1-(2-azidobenzoyl)-3-(1H-indol-3-ylmethyl)-6-methylpiperazine-2,5-dione Traditional Name: (3R,6S)-1-(2-azidobenzoyl)-3-(1H-indol-3-ylmethyl)-6-methyl-piperazine-2,5-quinone Formula: C21H18N6O3 MolecularWeight: 402.40602

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC(C(=O)N1C(=O)C2=CC=CC=C2N=[N+]=[N-])CC3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@H]1C(=O)N[C@@H](C(=O)N1C(=O)C2=CC=CC=C2N=[N+]=[N-])CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H18N6O3/c1-12-19(28)24-18(10-13-11-23-16-8-4-2-6-14(13)16)21(30)27(12)20(29)15-7-3-5-9-17(15)25-26-22/h2-9,11-12,18,23H,10H2,1H3,(H,24,28)/t12-,18+/m0/s1