methyl 2-[[(2R)-3-(1H-indol-3-yl)-2-(phenoxycarbonylamino)propanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[(2R)-3-(1H-indol-3-yl)-2-(phenoxycarbonylamino)propanoyl]amino]ethanoate Openeye Name: methyl 2-[[(2R)-3-(1H-indol-3-yl)-2-(phenoxycarbonylamino)propanoyl]amino]acetate CAS Name: 2-[[(2R)-3-(1H-indol-3-yl)-1-oxo-2-[[oxo(phenoxy)methyl]amino]propyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(2R)-3-(1H-indol-3-yl)-2-(phenoxycarbonylamino)propanoyl]amino]acetate Traditional Name: 2-[[(2R)-2-(carbophenoxyamino)-3-(1H-indol-3-yl)propanoyl]amino]acetic acid methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)OC3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O5/c1-28-19(25)13-23-20(26)18(24-21(27)29-15-7-3-2-4-8-15)11-14-12-22-17-10-6-5-9-16(14)17/h2-10,12,18,22H,11,13H2,1H3,(H,23,26)(H,24,27)/t18-/m1/s1