2-azanyl-2-[1-[3-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)indol-1-yl]indol-3-yl]propanoic acid

Systemtic Name: 2-azanyl-2-[1-[3-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)indol-1-yl]indol-3-yl]propanoic acid Openeye Name: 2-amino-2-[1-[3-(2-amino-3-hydroxy-3-oxo-propyl)indol-1-yl]indol-3-yl]propanoic acid CAS Name: 2-amino-2-[1-[3-(2-amino-3-hydroxy-3-oxopropyl)-1-indolyl]-3-indolyl]propanoic acid IUPAC Name: 2-amino-2-[1-[3-(2-amino-3-hydroxy-3-oxopropyl)indol-1-yl]indol-3-yl]propanoic acid Traditional Name: 2-amino-2-[1-[3-(2-amino-3-hydroxy-3-keto-propyl)indol-1-yl]indol-3-yl]propionic acid Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN(C2=CC=CC=C21)N3C=C(C4=CC=CC=C43)CC(C(=O)O)N)(C(=O)O)N

Isomeric SMILES

CC(C1=CN(C2=CC=CC=C21)N3C=C(C4=CC=CC=C43)CC(C(=O)O)N)(C(=O)O)N

InChI

InChI=1S/C22H22N4O4/c1-22(24,21(29)30)16-12-26(19-9-5-3-7-15(16)19)25-11-13(10-17(23)20(27)28)14-6-2-4-8-18(14)25/h2-9,11-12,17H,10,23-24H2,1H3,(H,27,28)(H,29,30)