methyl 4-[[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]benzoate

Systemtic Name: methyl 4-[[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]benzoate Openeye Name: methyl 4-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]benzoic acid methyl ester Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)N

InChI

InChI=1S/C19H19N3O3/c1-25-19(24)12-6-8-14(9-7-12)22-18(23)16(20)10-13-11-21-17-5-3-2-4-15(13)17/h2-9,11,16,21H,10,20H2,1H3,(H,22,23)/t16-/m0/s1