N-[(2S)-1-[[(1R)-1-(1-adamantyl)ethyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-ethoxy-benzamide

Systemtic Name: N-[(2S)-1-[[(1R)-1-(1-adamantyl)ethyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-ethoxy-benzamide Openeye Name: N-[(1S)-1-[[(1R)-1-(1-adamantyl)ethyl]carbamoyl]-2-methyl-propyl]-4-ethoxy-benzamide CAS Name: N-[(2S)-1-[[(1R)-1-(1-adamantyl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]-4-ethoxybenzamide IUPAC Name: N-[(2S)-1-[[(1R)-1-(1-adamantyl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]-4-ethoxybenzamide Traditional Name: N-[(1S)-1-[[(1R)-1-(1-adamantyl)ethyl]carbamoyl]-2-methyl-propyl]-4-ethoxy-benzamide Formula: C26H38N2O3 MolecularWeight: 426.59152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC(C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C26H38N2O3/c1-5-31-22-8-6-21(7-9-22)24(29)28-23(16(2)3)25(30)27-17(4)26-13-18-10-19(14-26)12-20(11-18)15-26/h6-9,16-20,23H,5,10-15H2,1-4H3,(H,27,30)(H,28,29)/t17-,18?,19?,20?,23+,26?/m1/s1