(2-chloranylquinolin-3-yl)methyl 3-(1-adamantylcarbonylamino)propanoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 3-(1-adamantylcarbonylamino)propanoate Openeye Name: (2-chloro-3-quinolyl)methyl 3-(adamantane-1-carbonylamino)propanoate CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]propanoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 3-(adamantane-1-carbonylamino)propanoate Traditional Name: 3-(adamantane-1-carbonylamino)propionic acid (2-chloro-3-quinolyl)methyl ester Formula: C24H27ClN2O3 MolecularWeight: 426.93578

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)OCC4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)OCC4=CC5=CC=CC=C5N=C4Cl

InChI

InChI=1S/C24H27ClN2O3/c25-22-19(10-18-3-1-2-4-20(18)27-22)14-30-21(28)5-6-26-23(29)24-11-15-7-16(12-24)9-17(8-15)13-24/h1-4,10,15-17H,5-9,11-14H2,(H,26,29)