bis(phenylmethyl) (2R)-2-[[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]pentanedioate

Systemtic Name: bis(phenylmethyl) (2R)-2-[[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]pentanedioate Openeye Name: dibenzyl (2R)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]pentanedioate CAS Name: (2R)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (2R)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]pentanedioate Traditional Name: (2R)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]glutaric acid dibenzyl ester Formula: C30H31N3O5 MolecularWeight: 513.58424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(C(=O)OCC2=CC=CC=C2)NC(=O)C(CC3=CNC4=CC=CC=C43)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CC[C@H](C(=O)OCC2=CC=CC=C2)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C30H31N3O5/c31-25(17-23-18-32-26-14-8-7-13-24(23)26)29(35)33-27(30(36)38-20-22-11-5-2-6-12-22)15-16-28(34)37-19-21-9-3-1-4-10-21/h1-14,18,25,27,32H,15-17,19-20,31H2,(H,33,35)/t25-,27+/m0/s1