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

Systemtic Name: 2-[[2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoyl]amino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)-1-oxopropyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propionic acid Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)N

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)N

InChI

InChI=1S/C22H22N4O5/c23-17(5-11-9-24-18-3-1-13(27)7-15(11)18)21(29)26-20(22(30)31)6-12-10-25-19-4-2-14(28)8-16(12)19/h1-4,7-10,17,20,24-25,27-28H,5-6,23H2,(H,26,29)(H,30,31)