2-azanyl-3-(4-hydroxyphenyl)propanoic acid; (E)-3-(4-hydroxyphenyl)prop-2-enoic acid

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)propanoic acid; (E)-3-(4-hydroxyphenyl)prop-2-enoic acid Openeye Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; (E)-3-(4-hydroxyphenyl)prop-2-enoic acid CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; (E)-3-(4-hydroxyphenyl)-2-propenoic acid IUPAC Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; (E)-3-(4-hydroxyphenyl)prop-2-enoic acid Traditional Name: 2-amino-3-(4-hydroxyphenyl)propionic acid; (E)-3-(4-hydroxyphenyl)acrylic acid Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)O.C1=CC(=CC=C1C=CC(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)O.C1=CC(=CC=C1/C=C/C(=O)O)O

InChI

InChI=1S/C9H11NO3.C9H8O3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;10-8-4-1-7(2-5-8)3-6-9(11)12/h1-4,8,11H,5,10H2,(H,12,13);1-6,10H,(H,11,12)/b;6-3+