N-[4-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-4-keto-butyl]adamantane-1-carboxamide Formula: C23H31ClN2O2 MolecularWeight: 402.95744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Cl)NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

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

InChI

InChI=1S/C23H31ClN2O2/c1-15(19-4-2-5-20(24)11-19)26-21(27)6-3-7-25-22(28)23-12-16-8-17(13-23)10-18(9-16)14-23/h2,4-5,11,15-18H,3,6-10,12-14H2,1H3,(H,25,28)(H,26,27)/t15-,16?,17?,18?,23?/m0/s1