N-[(2S)-1-oxidanylidene-1-[(3,4,5-trimethoxyphenyl)methylamino]propan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2S)-1-oxidanylidene-1-[(3,4,5-trimethoxyphenyl)methylamino]propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-1-methyl-2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]adamantane-1-carboxamide CAS Name: N-[(2S)-1-oxo-1-[(3,4,5-trimethoxyphenyl)methylamino]propan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-1-oxo-1-[(3,4,5-trimethoxyphenyl)methylamino]propan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[(3,4,5-trimethoxybenzyl)amino]ethyl]adamantane-1-carboxamide Formula: C24H34N2O5 MolecularWeight: 430.53716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=C(C(=C1)OC)OC)OC)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC(=C(C(=C1)OC)OC)OC)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H34N2O5/c1-14(26-23(28)24-10-15-5-16(11-24)7-17(6-15)12-24)22(27)25-13-18-8-19(29-2)21(31-4)20(9-18)30-3/h8-9,14-17H,5-7,10-13H2,1-4H3,(H,25,27)(H,26,28)/t14-,15?,16?,17?,24?/m0/s1