propan-2-yl 4-[2-(1-adamantylamino)ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-(1-adamantylamino)ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-(1-adamantylamino)acetyl]amino]benzoate CAS Name: 4-[[2-(1-adamantylamino)-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(1-adamantylamino)acetyl]amino]benzoate Traditional Name: 4-[[2-(1-adamantylamino)acetyl]amino]benzoic acid isopropyl ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CNC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CNC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30N2O3/c1-14(2)27-21(26)18-3-5-19(6-4-18)24-20(25)13-23-22-10-15-7-16(11-22)9-17(8-15)12-22/h3-6,14-17,23H,7-13H2,1-2H3,(H,24,25)