(3S,6S)-3-[(6-methoxy-1H-indol-3-yl)methyl]-6-(phenylmethyl)piperazine-2,5-dione

Systemtic Name: (3S,6S)-3-[(6-methoxy-1H-indol-3-yl)methyl]-6-(phenylmethyl)piperazine-2,5-dione Openeye Name: (3S,6S)-3-benzyl-6-[(6-methoxy-1H-indol-3-yl)methyl]piperazine-2,5-dione CAS Name: (3S,6S)-3-[(6-methoxy-1H-indol-3-yl)methyl]-6-(phenylmethyl)piperazine-2,5-dione IUPAC Name: (3S,6S)-3-benzyl-6-[(6-methoxy-1H-indol-3-yl)methyl]piperazine-2,5-dione Traditional Name: (3S,6S)-3-benzyl-6-[(6-methoxy-1H-indol-3-yl)methyl]piperazine-2,5-quinone Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CN2)CC3C(=O)NC(C(=O)N3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CN2)C[C@H]3C(=O)N[C@H](C(=O)N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3/c1-27-15-7-8-16-14(12-22-17(16)11-15)10-19-21(26)23-18(20(25)24-19)9-13-5-3-2-4-6-13/h2-8,11-12,18-19,22H,9-10H2,1H3,(H,23,26)(H,24,25)/t18-,19-/m0/s1