3-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbonylamino]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbonylamino]-3-pyridin-3-yl-propanoic acid Openeye Name: 3-[[3-(tert-butoxycarbonylamino)benzoyl]amino]-3-(3-pyridyl)propanoic acid CAS Name: 3-[[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-oxomethyl]amino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoyl]amino]-3-pyridin-3-ylpropanoic acid Traditional Name: 3-[[3-(tert-butoxycarbonylamino)benzoyl]amino]-3-(3-pyridyl)propionic acid Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NC(CC(=O)O)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NC(CC(=O)O)C2=CN=CC=C2

InChI

InChI=1S/C20H23N3O5/c1-20(2,3)28-19(27)22-15-8-4-6-13(10-15)18(26)23-16(11-17(24)25)14-7-5-9-21-12-14/h4-10,12,16H,11H2,1-3H3,(H,22,27)(H,23,26)(H,24,25)