2-[[2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-phenyl-propionic acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CC2=CNC3=C2C=C(C=C3)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CC2=CNC3=C2C=C(C=C3)O)N

InChI

InChI=1S/C20H21N3O4/c21-16(9-13-11-22-17-7-6-14(24)10-15(13)17)19(25)23-18(20(26)27)8-12-4-2-1-3-5-12/h1-7,10-11,16,18,22,24H,8-9,21H2,(H,23,25)(H,26,27)