2-azanyl-3-phenyl-propanoic acid; 2-azanyl-2-pyren-1-yl-propanoic acid

Systemtic Name: 2-azanyl-3-phenyl-propanoic acid; 2-azanyl-2-pyren-1-yl-propanoic acid Openeye Name: 2-amino-3-phenyl-propanoic acid; 2-amino-2-pyren-1-yl-propanoic acid CAS Name: 2-amino-3-phenylpropanoic acid; 2-amino-2-(1-pyrenyl)propanoic acid IUPAC Name: 2-amino-3-phenylpropanoic acid; 2-amino-2-pyren-1-ylpropanoic acid Traditional Name: 2-amino-3-phenyl-propionic acid; 2-amino-2-pyren-1-yl-propionic acid Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1)(C(=O)O)N.C1=CC=C(C=C1)CC(C(=O)O)N

Isomeric SMILES

CC(C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1)(C(=O)O)N.C1=CC=C(C=C1)CC(C(=O)O)N

InChI

InChI=1S/C19H15NO2.C9H11NO2/c1-19(20,18(21)22)15-10-8-13-6-5-11-3-2-4-12-7-9-14(15)17(13)16(11)12;10-8(9(11)12)6-7-4-2-1-3-5-7/h2-10H,20H2,1H3,(H,21,22);1-5,8H,6,10H2,(H,11,12)