methyl (2S)-2-[[4-(1-adamantyl)quinolin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-2-[[4-(1-adamantyl)quinolin-2-yl]carbonylamino]propanoate Openeye Name: methyl (2S)-2-[[4-(1-adamantyl)quinoline-2-carbonyl]amino]propanoate CAS Name: (2S)-2-[[[4-(1-adamantyl)-2-quinolinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[4-(1-adamantyl)quinoline-2-carbonyl]amino]propanoate Traditional Name: (2S)-2-[[4-(1-adamantyl)quinoline-2-carbonyl]amino]propionic acid methyl ester Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1=NC2=CC=CC=C2C(=C1)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@@H](C(=O)OC)NC(=O)C1=NC2=CC=CC=C2C(=C1)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H28N2O3/c1-14(23(28)29-2)25-22(27)21-10-19(18-5-3-4-6-20(18)26-21)24-11-15-7-16(12-24)9-17(8-15)13-24/h3-6,10,14-17H,7-9,11-13H2,1-2H3,(H,25,27)/t14-,15?,16?,17?,24?/m0/s1