2-azanyl-3-[1-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]indol-3-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[1-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]indol-3-yl]propanoic acid Openeye Name: 2-amino-3-[1-[2-amino-3-(4-hydroxyphenyl)propanoyl]indol-3-yl]propanoic acid CAS Name: 2-amino-3-[1-[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-3-indolyl]propanoic acid IUPAC Name: 2-amino-3-[1-[2-amino-3-(4-hydroxyphenyl)propanoyl]indol-3-yl]propanoic acid Traditional Name: 2-amino-3-(1-tyrosylindol-3-yl)propionic acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C(=O)C(CC3=CC=C(C=C3)O)N)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C(=O)C(CC3=CC=C(C=C3)O)N)CC(C(=O)O)N

InChI

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