N-[(2R)-3-methyl-1-oxidanylidene-1-[(3,4,5-trimethoxyphenyl)amino]butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-3-methyl-1-oxidanylidene-1-[(3,4,5-trimethoxyphenyl)amino]butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1R)-2-methyl-1-[(3,4,5-trimethoxyphenyl)carbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[(2R)-3-methyl-1-oxo-1-(3,4,5-trimethoxyanilino)butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-3-methyl-1-oxo-1-(3,4,5-trimethoxyanilino)butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1R)-2-methyl-1-[(3,4,5-trimethoxyphenyl)carbamoyl]propyl]adamantane-1-carboxamide Formula: C25H36N2O5 MolecularWeight: 444.56374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O5/c1-14(2)21(23(28)26-18-9-19(30-3)22(32-5)20(10-18)31-4)27-24(29)25-11-15-6-16(12-25)8-17(7-15)13-25/h9-10,14-17,21H,6-8,11-13H2,1-5H3,(H,26,28)(H,27,29)/t15?,16?,17?,21-,25?/m1/s1