pentyl 4-(1-adamantylcarbamoylamino)benzoate

Systemtic Name: pentyl 4-(1-adamantylcarbamoylamino)benzoate Openeye Name: pentyl 4-(1-adamantylcarbamoylamino)benzoate CAS Name: 4-[[(1-adamantylamino)-oxomethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-(1-adamantylcarbamoylamino)benzoate Traditional Name: 4-(1-adamantylcarbamoylamino)benzoic acid amyl ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N2O3/c1-2-3-4-9-28-21(26)19-5-7-20(8-6-19)24-22(27)25-23-13-16-10-17(14-23)12-18(11-16)15-23/h5-8,16-18H,2-4,9-15H2,1H3,(H2,24,25,27)