methyl 2-[[4-(2-adamantylcarbonylamino)phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-(2-adamantylcarbonylamino)phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-(adamantane-2-carbonylamino)benzoyl]amino]acetate CAS Name: 2-[[[4-[[2-adamantyl(oxo)methyl]amino]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(adamantane-2-carbonylamino)benzoyl]amino]acetate Traditional Name: 2-[[4-(adamantane-2-carbonylamino)benzoyl]amino]acetic acid methyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H26N2O4/c1-27-18(24)11-22-20(25)14-2-4-17(5-3-14)23-21(26)19-15-7-12-6-13(9-15)10-16(19)8-12/h2-5,12-13,15-16,19H,6-11H2,1H3,(H,22,25)(H,23,26)