N-[(2S)-1-(1-adamantylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-ethoxy-benzamide

Systemtic Name: N-[(2S)-1-(1-adamantylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-ethoxy-benzamide Openeye Name: N-[(1S)-1-(1-adamantylcarbamoyl)-2-methyl-propyl]-4-ethoxy-benzamide CAS Name: N-[(2S)-1-(1-adamantylamino)-3-methyl-1-oxobutan-2-yl]-4-ethoxybenzamide IUPAC Name: N-[(2S)-1-(1-adamantylamino)-3-methyl-1-oxobutan-2-yl]-4-ethoxybenzamide Traditional Name: N-[(1S)-1-(1-adamantylcarbamoyl)-2-methyl-propyl]-4-ethoxy-benzamide Formula: C24H34N2O3 MolecularWeight: 398.53836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H34N2O3/c1-4-29-20-7-5-19(6-8-20)22(27)25-21(15(2)3)23(28)26-24-12-16-9-17(13-24)11-18(10-16)14-24/h5-8,15-18,21H,4,9-14H2,1-3H3,(H,25,27)(H,26,28)/t16?,17?,18?,21-,24?/m0/s1