methyl (2S)-3-(1H-indol-3-yl)-2-[(4-methoxyphenyl)methylcarbamoylamino]propanoate

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-[(4-methoxyphenyl)methylcarbamoylamino]propanoate Openeye Name: methyl (2S)-3-(1H-indol-3-yl)-2-[(4-methoxyphenyl)methylcarbamoylamino]propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[[(4-methoxyphenyl)methylamino]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-[(4-methoxyphenyl)methylcarbamoylamino]propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(p-anisylcarbamoylamino)propionic acid methyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H23N3O4/c1-27-16-9-7-14(8-10-16)12-23-21(26)24-19(20(25)28-2)11-15-13-22-18-6-4-3-5-17(15)18/h3-10,13,19,22H,11-12H2,1-2H3,(H2,23,24,26)/t19-/m0/s1