2-(2-adamantyloxycarbonylamino)-2-(4H-quinolin-1-yl)propanoic acid

Systemtic Name: 2-(2-adamantyloxycarbonylamino)-2-(4H-quinolin-1-yl)propanoic acid Openeye Name: 2-(2-adamantyloxycarbonylamino)-2-(4H-quinolin-1-yl)propanoic acid CAS Name: 2-[[2-adamantyloxy(oxo)methyl]amino]-2-(4H-quinolin-1-yl)propanoic acid IUPAC Name: 2-(2-adamantyloxycarbonylamino)-2-(4H-quinolin-1-yl)propanoic acid Traditional Name: 2-(2-adamantyloxycarbonylamino)-2-(4H-quinolin-1-yl)propionic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)(NC(=O)OC1C2CC3CC(C2)CC1C3)N4C=CCC5=CC=CC=C54

Isomeric SMILES

CC(C(=O)O)(NC(=O)OC1C2CC3CC(C2)CC1C3)N4C=CCC5=CC=CC=C54

InChI

InChI=1S/C23H28N2O4/c1-23(21(26)27,25-8-4-6-16-5-2-3-7-19(16)25)24-22(28)29-20-17-10-14-9-15(12-17)13-18(20)11-14/h2-5,7-8,14-15,17-18,20H,6,9-13H2,1H3,(H,24,28)(H,26,27)