N-[(2S)-1-[(3-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2S)-1-[(3-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-2-(3-acetylanilino)-1-methyl-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[(2S)-1-(3-acetylanilino)-1-oxopropan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-1-(3-acetylanilino)-1-oxopropan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-2-(3-acetylanilino)-2-keto-1-methyl-ethyl]adamantane-1-carboxamide Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC(=C1)C(=O)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28N2O3/c1-13(20(26)24-19-5-3-4-18(9-19)14(2)25)23-21(27)22-10-15-6-16(11-22)8-17(7-15)12-22/h3-5,9,13,15-17H,6-8,10-12H2,1-2H3,(H,23,27)(H,24,26)/t13-,15?,16?,17?,22?/m0/s1