methyl 3-(4-phenoxybutanoylamino)adamantane-1-carboxylate

Systemtic Name: methyl 3-(4-phenoxybutanoylamino)adamantane-1-carboxylate Openeye Name: methyl 3-(4-phenoxybutanoylamino)adamantane-1-carboxylate CAS Name: 3-[(1-oxo-4-phenoxybutyl)amino]-1-adamantanecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-phenoxybutanoylamino)adamantane-1-carboxylate Traditional Name: 3-(4-phenoxybutanoylamino)adamantane-1-carboxylic acid methyl ester Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CC3CC(C1)CC(C3)(C2)NC(=O)CCCOC4=CC=CC=C4

Isomeric SMILES

COC(=O)C12CC3CC(C1)CC(C3)(C2)NC(=O)CCCOC4=CC=CC=C4

InChI

InChI=1S/C22H29NO4/c1-26-20(25)21-11-16-10-17(12-21)14-22(13-16,15-21)23-19(24)8-5-9-27-18-6-3-2-4-7-18/h2-4,6-7,16-17H,5,8-15H2,1H3,(H,23,24)