3-[ethanoyl-[3-(pyridin-2-ylamino)propoxycarbonylamino]amino]-3-phenyl-propanoic acid

Systemtic Name: 3-[ethanoyl-[3-(pyridin-2-ylamino)propoxycarbonylamino]amino]-3-phenyl-propanoic acid Openeye Name: 3-[acetyl-[3-(2-pyridylamino)propoxycarbonylamino]amino]-3-phenyl-propanoic acid CAS Name: 3-[acetyl-[[oxo-[3-(2-pyridinylamino)propoxy]methyl]amino]amino]-3-phenylpropanoic acid IUPAC Name: 3-[acetyl-[3-(pyridin-2-ylamino)propoxycarbonylamino]amino]-3-phenylpropanoic acid Traditional Name: 3-[acetyl-[3-(2-pyridylamino)propoxycarbonylamino]amino]-3-phenyl-propionic acid Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(CC(=O)O)C1=CC=CC=C1)NC(=O)OCCCNC2=CC=CC=N2

Isomeric SMILES

CC(=O)N(C(CC(=O)O)C1=CC=CC=C1)NC(=O)OCCCNC2=CC=CC=N2

InChI

InChI=1S/C20H24N4O5/c1-15(25)24(17(14-19(26)27)16-8-3-2-4-9-16)23-20(28)29-13-7-12-22-18-10-5-6-11-21-18/h2-6,8-11,17H,7,12-14H2,1H3,(H,21,22)(H,23,28)(H,26,27)