2-[carboxy(3-phenylpropyl)amino]-5-pyridin-2-yl-pent-4-ynoic acid

Systemtic Name: 2-[carboxy(3-phenylpropyl)amino]-5-pyridin-2-yl-pent-4-ynoic acid Openeye Name: 2-[carboxy(3-phenylpropyl)amino]-5-(2-pyridyl)pent-4-ynoic acid CAS Name: 2-[carboxy(3-phenylpropyl)amino]-5-(2-pyridinyl)-4-pentynoic acid IUPAC Name: 2-[carboxy(3-phenylpropyl)amino]-5-pyridin-2-ylpent-4-ynoic acid Traditional Name: 2-[carboxy(3-phenylpropyl)amino]-5-(2-pyridyl)pent-4-ynoic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN(C(CC#CC2=CC=CC=N2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCN(C(CC#CC2=CC=CC=N2)C(=O)O)C(=O)O

InChI

InChI=1S/C20H20N2O4/c23-19(24)18(13-6-12-17-11-4-5-14-21-17)22(20(25)26)15-7-10-16-8-2-1-3-9-16/h1-5,8-9,11,14,18H,7,10,13,15H2,(H,23,24)(H,25,26)