2-azanyl-3-[2-(3-pyridin-2-ylpropylcarbamoyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(3-pyridin-2-ylpropylcarbamoyl)phenyl]propanoic acid Openeye Name: 2-amino-3-[2-[3-(2-pyridyl)propylcarbamoyl]phenyl]propanoic acid CAS Name: 2-amino-3-[2-[oxo-[3-(2-pyridinyl)propylamino]methyl]phenyl]propanoic acid IUPAC Name: 2-amino-3-[2-(3-pyridin-2-ylpropylcarbamoyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[2-[3-(2-pyridyl)propylcarbamoyl]phenyl]propionic acid Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(C(=O)O)N)C(=O)NCCCC2=CC=CC=N2

Isomeric SMILES

C1=CC=C(C(=C1)CC(C(=O)O)N)C(=O)NCCCC2=CC=CC=N2

InChI

InChI=1S/C18H21N3O3/c19-16(18(23)24)12-13-6-1-2-9-15(13)17(22)21-11-5-8-14-7-3-4-10-20-14/h1-4,6-7,9-10,16H,5,8,11-12,19H2,(H,21,22)(H,23,24)