dimethyl (2S)-2-[[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]butanedioate

Systemtic Name: dimethyl (2S)-2-[[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]butanedioate Openeye Name: dimethyl (2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]butanedioate CAS Name: (2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]butanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]butanedioate Traditional Name: (2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]succinic acid dimethyl ester Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)OC)NC(=O)C(CC1=CNC2=CC=CC=C21)N

Isomeric SMILES

COC(=O)C[C@@H](C(=O)OC)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)N

InChI

InChI=1S/C17H21N3O5/c1-24-15(21)8-14(17(23)25-2)20-16(22)12(18)7-10-9-19-13-6-4-3-5-11(10)13/h3-6,9,12,14,19H,7-8,18H2,1-2H3,(H,20,22)/t12-,14-/m0/s1