2-(2-adamantyloxycarbonylamino)-3-(4H-quinolin-1-yl)propanoic acid

Systemtic Name: 2-(2-adamantyloxycarbonylamino)-3-(4H-quinolin-1-yl)propanoic acid Openeye Name: 2-(2-adamantyloxycarbonylamino)-3-(4H-quinolin-1-yl)propanoic acid CAS Name: 2-[[2-adamantyloxy(oxo)methyl]amino]-3-(4H-quinolin-1-yl)propanoic acid IUPAC Name: 2-(2-adamantyloxycarbonylamino)-3-(4H-quinolin-1-yl)propanoic acid Traditional Name: 2-(2-adamantyloxycarbonylamino)-3-(4H-quinolin-1-yl)propionic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CN(C2=CC=CC=C21)CC(C(=O)O)NC(=O)OC3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1C=CN(C2=CC=CC=C21)CC(C(=O)O)NC(=O)OC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C23H28N2O4/c26-22(27)19(13-25-7-3-5-16-4-1-2-6-20(16)25)24-23(28)29-21-17-9-14-8-15(11-17)12-18(21)10-14/h1-4,6-7,14-15,17-19,21H,5,8-13H2,(H,24,28)(H,26,27)