propan-2-yl 4-(1-adamantylcarbamoylamino)benzoate

Systemtic Name: propan-2-yl 4-(1-adamantylcarbamoylamino)benzoate Openeye Name: isopropyl 4-(1-adamantylcarbamoylamino)benzoate CAS Name: 4-[[(1-adamantylamino)-oxomethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(1-adamantylcarbamoylamino)benzoate Traditional Name: 4-(1-adamantylcarbamoylamino)benzoic acid isopropyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O3/c1-13(2)26-19(24)17-3-5-18(6-4-17)22-20(25)23-21-10-14-7-15(11-21)9-16(8-14)12-21/h3-6,13-16H,7-12H2,1-2H3,(H2,22,23,25)