methyl 5-(1-adamantyl)-2-[[(phenylmethyl)amino]methyl]furan-3-carboxylate

Systemtic Name: methyl 5-(1-adamantyl)-2-[[(phenylmethyl)amino]methyl]furan-3-carboxylate Openeye Name: methyl 5-(1-adamantyl)-2-[(benzylamino)methyl]furan-3-carboxylate CAS Name: 5-(1-adamantyl)-2-[[(phenylmethyl)amino]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(1-adamantyl)-2-[(benzylamino)methyl]furan-3-carboxylate Traditional Name: 5-(1-adamantyl)-2-[(benzylamino)methyl]furan-3-carboxylic acid methyl ester Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC(=C1)C23CC4CC(C2)CC(C4)C3)CNCC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(OC(=C1)C23CC4CC(C2)CC(C4)C3)CNCC5=CC=CC=C5

InChI

InChI=1S/C24H29NO3/c1-27-23(26)20-10-22(24-11-17-7-18(12-24)9-19(8-17)13-24)28-21(20)15-25-14-16-5-3-2-4-6-16/h2-6,10,17-19,25H,7-9,11-15H2,1H3